reading ASCII orbitals for casscf calculation
Seth Olsen
seth at spawn.scs.uiuc.edu
Mon Oct 21 06:35:49 BST 2002
Thank you Doctor! Your prescription is good medicine, and the problem was duly solved.
Seth Olsen
H. -J. Werner wrote:
> The reason probably is that "MULTI" is recognized bu matrop
> as 'MULTIPLICATION' (mult). Please try if it works if you
> replace multi by mcscf or casscf (these are aliases to multi).
> Or put some dummy input (text, label...) between matrop and multi.
> Best regards
> H.-J. Werner
> On Son, 20 Okt 2002, Seth Olsen wrote:
>
> >
> >I have been using MolPro for a few years now, and am in general quite impressed with it. In particular, the CASSCF convergence engine is the best I have come across without question. However, I have always been frustrated by the fact that the .wfn file (file 2), being binary, cannot be restarted across machine architectures. This has slowed the pace of my work on several occasions.
> >
> >I thought I had found a way around this problem, namely by invoking the READ and SAVE commands in MATROP to load in ASCII orbitals from a text file, and similarly to use LOAD and WRITE to dump orbitals to ASCII files after completion of a job. This works fine when I have tried it on HF calculations, but with similar input the scheme fails to work when I feed the orbitals thus read into MULTI. Curiously, MolPro seems to read in the orbitals from the ASCII file, but then seems to skip the MULTI command,
whi
> >ch causes it to interpret all the options for MULTI as illegal commands. I was wondering if this is the result of a bug in the program, or if some more special options to MULTI or MATROP are necessary in order to make this work.
> >
> >I have attached three output files to this communique, in each of which the respective input deck is echoed. The first is a Hartree-Fock (HF) calculation started with read-in ASCII orbitals, which seems to work fine. The second is a calculation on an identical molecule and geometry/basis, but instead of HF, the read-in orbitals are passed to MULTI. This calculation fails. The third file is the orbital ASCII file that both are reading. I would be extremely grateful for any insight offered to help me
wit
> >h this problem. Thank you.
> >
>
> >
> > Primary working directories: /u/s/seth/molpro
> > Secondary working directories: /u/s/seth/molpro
> >
> > blaslib=hpblas_pa20_64
> > mxmblk=120 mxmbln=120 ncache= 43200 mindgm= 33 mindgv= 32 mindgc= 33 mindgl= 33 mindgr= 33 noblas=0 nroll=4 minvec=7
> > default implementation of scratch files=df
> >
> > ***,single point energy of GFP anion w/ 6-31G / s1 / EOM-CCSD
> > !using the optimized geometry from CAS(2/2) calculation
> > gprint,orbitals,civector; !print the orbitals
> > memory,25,m
> > FILE,1,adfthforbtest.int,new
> > FILE,2,adfthforbtest.wfn
> > PUNCH,adfthforbtest.pun,new
> > geometry={nosymm,noorient;angstrom;
> > N3I;
> > H1N3I, 1, RNH1;
> > C4I, 1, RCN2, 2, ACNH1;
> > H1C4I, 3, RCH3, 1, AHCN2, 2, DHCNH1;
> > N5I, 3, RCN4, 1, ANCN3, 2, DNCNH2;
> > C1I, 5, RCN5, 3, ACNC4, 1, DCNCN3;
> > C2I, 6, RCC6, 5, ACCN5, 3, DCCNC4;
> > O1C2I, 7, RCO7, 1, AOCN6, 3, DOCNC5;
> > C1B, 6, RCC8, 7, ACCC7, 8, DCCCO6;
> > H1C1B, 9, RCH9, 6, AHCC8, 7, DHCCC7;
> > C1P, 9, RCC10, 6, ACCC9, 5, DCCCN8;
> > C2P, 11, RCC11, 9, ACCC10, 6, DCCCC9;
> > H1C2P, 12, RCH12, 11, AHCC11, 9, DHCCC10;
> > C3P, 12, RCC13, 11, ACCC12, 9, DCCCC11;
> > H1C3P, 14, RCH14, 12, AHCC13, 11, DHCCC12;
> > C4P, 14, RCC15, 12, ACCC14, 11, DCCCC13;
> > C5P, 16, RCC16, 14, ACCC15, 12, DCCCC14;
> > H1C5P, 17, RCH17, 16, AHCC16, 14, DHCCC15;
> > C6P, 17, RCC18, 16, ACCC17, 14, DCCCC16;
> > H1C6P, 19, RCH19, 11, AHCC18, 12, DHCCC17;
> > O1C4P, 16, RCO20, 17, AOCC19, 19, DOCCC18;
> > }
> > RNH1 = 1.005747399,
> > RCN2 = 1.3945882092,
> > ACNH1 = 128.0013571362,
> > RCH3 = 1.0797225562,
> > AHCN2 = 122.3460687393,
> > DHCNH1 = .3176017435,
> > RCN4 = 1.3134755048,
> > ANCN3 = 112.53691522,
> > DNCNH2 = -179.7392991266,
> > RCN5 = 1.4236637916,
> > ACNC4 = 106.3851163995,
> > DCNCN3 = .0425985123,
> > RCC6 = 1.4580637676,
> > ACCN5 = 109.5997506423,
> > DCCNC4 = -.0046725228,
> > RCO7 = 1.2635478249,
> > AOCN6 = 124.377425139,
> > DOCNC5 = -179.936707378,
> > RCC8 = 1.3919476044
> > ACCC7 = 123.0132405084,
> > DCCCO6 = -.0826599548,
> > RCH9 = 1.0916391744,
> > AHCC8 = 112.7288126832,
> > DHCCC7 = .0516503223,
> > RCC10 = 1.4081218616,
> > ACCC9 = 131.681001285,
> > DCCCN8 = -.006777037,
> > RCC11 = 1.440218179,
> > ACCC10 = 123.9863979838,
> > DCCCC9 = -.037849871,
> > RCH12 = 1.0848026812,
> > AHCC11 = 117.3600052667,
> > DHCCC10 = .0354370882,
> > RCC13 = 1.3706965261,
> > ACCC12 = 121.4414468782,
> > DCCCC11 = -179.9748659666,
> > RCH14 = 1.0868211545,
> > AHCC13 = 121.0604969298,
> > DHCCC12 = 179.9868388872,
> > RCC15 = 1.4585766318,
> > ACCC14 = 122.5576042229,
> > DCCCC13 = .0085101095,
> > RCC16 = 1.4576830269,
> > ACCC15 = 115.2202315751,
> > DCCCC14 = -.0130136984,
> > RCH17 = 1.0865772129,
> > AHCC16 = 116.6765489817,
> > DHCCC15 = -179.9975417066,
> > RCC18 = 1.3710085894,
> > ACCC17 = 121.7561012207,
> > DCCCC16 = .0139088911,
> > RCH19 = 1.0900476701,
> > AHCC18 = 117.8142224997,
> > DHCCC17 = -179.9911160458,
> > RCO20 = 1.2805054795,
> > AOCC19 = 122.3700215446,
> > DOCCC18 = -179.985549464;
> >
> >
> >
> > basis=6-31G;
> >
> > matrop
> > read,orbitals,orbitals
> > Including file /usr1/seth/tests/molpro/adfthforbtest.orb
> > save,orbitals,2101.2,orbitals
> >
> >
> > hf
> > start,2101.2
> > wf,98,1,0
> > save,2101.2
> >
> >
> > matrop
> > load,orbitals,orb,2101.2
> > write,orbitals,adfthforbtest.orb,new
> > ---
> >1
> >
> >
> > *** PROGRAM SYSTEM MOLPRO ***
> > Copyright, University of Birmingham, 1997
> >
> > Version 2002.4 linked 22, Aug AM 2002
> >
> >
> > **********************************************************************************************************************************
> > LABEL * SINGLE POINT ENERGY OF GFP ANION W/ 6-31G / S1 / EOM-CCSD
> > HP-UX-B.11.11/mesa113(9000/785) 64 bit version DATE: 20-Oct-02 TIME: 21:45:57
> > **********************************************************************************************************************************
> >
> > Installed patches: blas5 cc_ifc chgfracfix cilssym drv2el_llmp2 ecp_parse
> > fitmos fitmos6 ga_avqz ibm64_gmainv linux_gmalloc linux_ia64
> > linuxconf linuxconf2 linuxtune molproc_cray molproc_ibm myrinetports
> > opt_linear_triatomic p3_mkl parse_ibm rccsd rilmp2g_5 rs2grad
> > t1diag_uccsd2 test_cfit
> > **********************************************************************************************************************************
> >
> >
> > Variable memory set to 25000000 words, buffer space 230000 words
> >
> >
> > Permanent file 1 adfthforbtest.int assigned. Implementation=df
> > Permanent file 2 adfthforbtest.wfn assigned. Implementation=df
> >
> >
> > PUNCHFILE ADFTHFORBTEST.PUN OPENED
> > SETTING RNH1 = 1.00574740
> > SETTING RCN2 = 1.39458821
> > SETTING ACNH1 = 128.00135714
> > SETTING RCH3 = 1.07972256
> > SETTING AHCN2 = 122.34606874
> > SETTING DHCNH1 = 0.31760174
> > SETTING RCN4 = 1.31347550
> > SETTING ANCN3 = 112.53691522
> > SETTING DNCNH2 = -179.73929913
> > SETTING RCN5 = 1.42366379
> > SETTING ACNC4 = 106.38511640
> > SETTING DCNCN3 = 0.04259851
> > SETTING RCC6 = 1.45806377
> > SETTING ACCN5 = 109.59975064
> > SETTING DCCNC4 = -0.00467252
> > SETTING RCO7 = 1.26354782
> > SETTING AOCN6 = 124.37742514
> > SETTING DOCNC5 = -179.93670738
> > SETTING RCC8 = 1.39194760
> > SETTING ACCC7 = 123.01324051
> > SETTING DCCCO6 = -0.08265995
> > SETTING RCH9 = 1.09163917
> > SETTING AHCC8 = 112.72881268
> > SETTING DHCCC7 = 0.05165032
> > SETTING RCC10 = 1.40812186
> > SETTING ACCC9 = 131.68100129
> > SETTING DCCCN8 = -0.00677704
> > SETTING RCC11 = 1.44021818
> > SETTING ACCC10 = 123.98639798
> > SETTING DCCCC9 = -0.03784987
> > SETTING RCH12 = 1.08480268
> > SETTING AHCC11 = 117.36000527
> > SETTING DHCCC10 = 0.03543709
> > SETTING RCC13 = 1.37069653
> > SETTING ACCC12 = 121.44144688
> > SETTING DCCCC11 = -179.97486597
> > SETTING RCH14 = 1.08682115
> > SETTING AHCC13 = 121.06049693
> > SETTING DHCCC12 = 179.98683889
> > SETTING RCC15 = 1.45857663
> > SETTING ACCC14 = 122.55760422
> > SETTING DCCCC13 = 0.00851011
> > SETTING RCC16 = 1.45768303
> > SETTING ACCC15 = 115.22023158
> > SETTING DCCCC14 = -0.01301370
> > SETTING RCH17 = 1.08657721
> > SETTING AHCC16 = 116.67654898
> > SETTING DHCCC15 = -179.99754171
> > SETTING RCC18 = 1.37100859
> > SETTING ACCC17 = 121.75610122
> > SETTING DCCCC16 = 0.01390889
> > SETTING RCH19 = 1.09004767
> > SETTING AHCC18 = 117.81422250
> > SETTING DHCCC17 = -179.99111605
> > SETTING RCO20 = 1.28050548
> > SETTING AOCC19 = 122.37002154
> > SETTING DOCCC18 = -179.98554946
> > SETTING BASIS = 6-31G
> >
> >
> > Using spherical harmonics
> >
> > Library entry N S 6-31G selected for orbital group 1
> > Library entry N P 6-31G selected for orbital group 1
> > Library entry H S 6-31G selected for orbital group 2
> > Library entry C S 6-31G selected for orbital group 3
> > Library entry C P 6-31G selected for orbital group 3
> > Library entry O S 6-31G selected for orbital group 4
> > Library entry O P 6-31G selected for orbital group 4
> >
> >1PROGRAM * SEWARD (Integral evaluation for generally contracted gaussian basis sets) Author: Roland Lindh, 1990
> >
> > Geometry written to block 1 of record 700
> >
> >
> > Point group C1
> >
> >
> >
> > ATOMIC COORDINATES
> >
> > NR ATOM CHARGE X Y Z
> >
> > 1 N3I 7.00 0.000000000 0.000000000 0.000000000
> > 2 N5I 7.00 0.010431302 1.414861300 -4.014785148
> > 3 H1N3 1.00 0.000000000 0.000000000 1.900586998
> > 4 H1C4 1.00 -0.009555190 3.998186714 -0.936365833
> > 5 H1C1 1.00 0.037048262 -4.842349200 -5.683459422
> > 6 H1C2 1.00 0.023252431 1.787785411 -8.471505200
> > 7 H1C3 1.00 0.035800670 2.555611264 -13.120290772
> > 8 H1C5 1.00 0.063544986 -5.505293123 -14.457131297
> > 9 H1C6 1.00 0.051902618 -6.262376978 -9.825928069
> > 10 C4I 6.00 0.000000000 2.076676899 -1.622557028
> > 11 C1I 6.00 0.020040963 -1.275109007 -4.057993260
> > 12 C2I 6.00 0.014486441 -2.240975847 -1.477494395
> > 13 C1B 6.00 0.031245874 -2.838473524 -6.173357932
> > 14 C1P 6.00 0.036553864 -2.291919683 -8.777581938
> > 15 C2P 6.00 0.032216259 0.229126050 -9.803014834
> > 16 C3P 6.00 0.038723243 0.648069323 -12.359143125
> > 17 C4P 6.00 0.050702396 -1.404582167 -14.198633299
> > 18 C5P 6.00 0.054725214 -3.941821889 -13.126095184
> > 19 C6P 6.00 0.048183491 -4.340049751 -10.566061048
> > 20 O1C2 8.00 0.020360044 -4.451321754 -0.574316511
> > 21 O1C4 8.00 0.057242341 -1.007042678 -16.585550415
> >
> > Bond lengths in Bohr (Angstrom)
> >
> > 1--3 1.900586998 1-10 2.635389582 1-12 2.684245200 2-10 2.482108797 2-11 2.690334466
> > (1.005747399) (1.394588209) (1.420441491) (1.313475505) (1.423663792)
> >
> > 4-10 2.040379775 5-13 2.062898918 6-15 2.049979819 7-16 2.053794181 8-18 2.053333198
> > (1.079722556) (1.091639174) (1.084802681) (1.086821155) (1.086577213)
> >
> > 9-19 2.059891411 11-12 2.755340995 11-13 2.630399563 12-20 2.387759163 13-14 2.660964477
> > (1.090047670) (1.458063768) (1.391947604) (1.263547825) (1.408121862)
> >
> > 14-15 2.721617722 14-19 2.719122937 15-16 2.590240848 16-17 2.756310167 17-18 2.754621499
> > (1.440218179) (1.438897996) (1.370696526) (1.458576632) (1.457683027)
> >
> > 17-21 2.419804483 18-19 2.590830562
> > (1.280505480) (1.371008589)
> >
> > Bond angles
> >
> > 1-10--2 112.53691522 1-10--4 122.34606874 1-12-11 102.87702134 1-12-20 124.37742514
> >
> > 2-10--4 125.11698909 2-11-12 109.59975064 2-11-13 127.38699328 3--1-10 128.00135714
> >
> > 3--1-12 123.39665352 5-13-11 112.72881268 5-13-14 115.59018558 6-15-14 117.36000527
> >
> > 6-15-16 121.19854703 7-16-15 121.06049693 7-16-17 116.38189554 8-18-17 116.67654898
> >
> > 8-18-19 121.56734878 9-19-14 117.81422250 9-19-18 119.89902767 10--1-12 108.60115839
> >
> > 10--2-11 106.38511640 11-12-20 132.74555306 11-13-14 131.68100129 12-11-13 123.01324051
> >
> > 13-14-15 123.98639798 13-14-19 119.27573100 14-15-16 121.44144688 14-19-18 122.28674971
> >
> > 15-14-19 116.73786479 15-16-17 122.55760422 16-17-18 115.22023158 16-17-21 122.40974688
> >
> > 17-18-19 121.75610122 18-17-21 122.37002154
> >
> > NUCLEAR CHARGE: 97
> > NUMBER OF PRIMITIVE AOS: 336
> > NUMBER OF SYMMETRY AOS: 336
> > NUMBER OF CONTRACTIONS: 140 ( 140A )
> > NUMBER OF CORE ORBITALS: 14 ( 14A )
> > NUMBER OF VALENCE ORBITALS: 63 ( 63A )
> >
> >
> > NUCLEAR REPULSION ENERGY 769.57885442
> >
> >
> > Eigenvalues of metric
> >
> > 1 0.656E-03 0.147E-02 0.198E-02 0.287E-02 0.359E-02 0.477E-02 0.553E-02 0.589E-02
> >
> >
> > Contracted 2-electron integrals neglected if value below 1.0D-11
> > AO integral compression algorithm 1 Integral accuracy 1.0D-11
> >
> > 101.450 MB (compressed) written to integral file ( 25.8%)
> >
> >
> > NUMBER OF SORTED TWO-ELECTRON INTEGRALS: 48713385. BUFFER LENGTH: 32768
> > NUMBER OF SEGMENTS: 4 SEGMENT LENGTH: 15834483 RECORD LENGTH: 65536
> >
> > Memory used in sort: 15.93 MW
> >
> > SORT1 READ 49003036. AND WROTE 24844521. INTEGRALS IN 571 RECORDS. CPU TIME: 7.40 SEC, REAL TIME: 22.56 SEC
> > SORT2 READ 24844521. AND WROTE 48713385. INTEGRALS IN 387 RECORDS. CPU TIME: 11.94 SEC, REAL TIME: 36.46 SEC
> >
> > FILE SIZES: FILE 1: 105.3 MBYTE, FILE 4: 299.4 MBYTE, TOTAL: 404.7 MBYTE
> >
> > OPERATOR DM FOR CENTER 0 COORDINATES: 0.000000 0.000000 0.000000
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 4 0.83 500 600 700 1000
> > VAR BASINP GEOM BASIS
> >
> > PROGRAMS * INT
> > CPU TIMES * 80.67
> > REAL TIME * 2 MIN, 5.52 SEC CPU TIME * 1 MIN,23.96 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
> >
> > PROGRAM * MATROP
> >
> >
> > READING MATRIX ORBITALS (ORBITALS) FROM INPUT. SYMMETRY=1
> >
> > Orbitals ORBITALS saved in record 2101.2 (set 1)
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 5 1.00 500 600 700 1000 2101
> > VAR BASINP GEOM BASIS MATROP
> >
> > PROGRAMS * MATROP INT
> > CPU TIMES * 2.29 80.67
> > REAL TIME * 2 MIN, 7.90 SEC CPU TIME * 1 MIN,26.26 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
> >
> >1PROGRAM * RHF-SCF (CLOSED SHELL) Authors: W. Meyer, H.-J. Werner
> >
> >
> > NUMBER OF ELECTRONS: 49+ 49- SPACE SYMMETRY=1 SPIN SYMMETRY=Singlet
> > CONVERGENCE THRESHOLDS: 1.00E-05 (Density) 1.00E-07 (Energy)
> > MAX. NUMBER OF ITERATIONS: 60
> > INTERPOLATION TYPE: DIIS
> > INTERPOLATION STEPS: 2 (START) 1 (STEP)
> > LEVEL SHIFTS: 0.00 (CLOSED) 0.00 (OPEN)
> >
> >
> >
> >
> > Molecular orbitals read from record 2101.2 Type=MATROP/MATROP
> >
> > Molecular orbital dump at record 2101.2
> >
> > ITERATION DDIFF GRAD ENERGY 2-EL.EN. DIPOLE MOMENTS DIIS
> > 1 0.000D+00 0.000D+00 -641.12706630 2007.699314 -0.040426 2.248648 10.531160 0
> > 2 0.000D+00 0.809D-06 -641.12706630 2007.699135 -0.040425 2.248678 10.530911 1
> > 3 0.147D-05 0.438D-06 -641.12706630 2007.699293 -0.040425 2.248644 10.530771 0
> >
> > Final occupancy: 49
> >
> > !RHF STATE 1.1 ENERGY -641.12706630
> > Nuclear energy 769.57885442
> > One-electron energy -2414.55556730
> > Two-electron energy 1003.84964658
> > Virial quotient -1.00047368
> > !RHF STATE 1.1 DIPOLE MOMENTS: -0.04042452 2.24864351 10.53077110
> >
> > ELECTRON ORBITALS
> > =================
> >
> >
> > Orb Occ Energy Couls-En Coefficients
> >
> > 1 1s 1 1s 1 1s 1 2px 1 2py 1 2pz 1 2px 1 2py 1 2pz 2 1s
> > 2 1s 2 1s 2 2px 2 2py 2 2pz 2 2px 2 2py 2 2pz 3 1s 3 1s
> > 4 1s 4 1s 5 1s 5 1s 6 1s 6 1s 7 1s 7 1s 8 1s 8 1s
> > 9 1s 9 1s 10 1s 10 1s 10 1s 10 2px 10 2py 10 2pz 10 2px 10 2py
> > 10 2pz 11 1s 11 1s 11 1s 11 2px 11 2py 11 2pz 11 2px 11 2py 11 2pz
> > 12 1s 12 1s 12 1s 12 2px 12 2py 12 2pz 12 2px 12 2py 12 2pz 13 1s
> > 13 1s 13 1s 13 2px 13 2py 13 2pz 13 2px 13 2py 13 2pz 14 1s 14 1s
> > 14 1s 14 2px 14 2py 14 2pz 14 2px 14 2py 14 2pz 15 1s 15 1s 15 1s
> > 15 2px 15 2py 15 2pz 15 2px 15 2py 15 2pz 16 1s 16 1s 16 1s 16 2px
> > 16 2py 16 2pz 16 2px 16 2py 16 2pz 17 1s 17 1s 17 1s 17 2px 17 2py
> > 17 2pz 17 2px 17 2py 17 2pz 18 1s 18 1s 18 1s 18 2px 18 2py 18 2pz
> > 18 2px 18 2py 18 2pz 19 1s 19 1s 19 1s 19 2px 19 2py 19 2pz 19 2px
> > 19 2py 19 2pz 20 1s 20 1s 20 1s 20 2px 20 2py 20 2pz 20 2px 20 2py
> > 20 2pz 21 1s 21 1s 21 1s 21 2px 21 2py 21 2pz 21 2px 21 2py 21 2pz
> >
> >
> > 1.1 2 -20.3956 -65.2355 -0.000028 -0.000412 0.003936 0.000000 -0.000061 0.000098 0.000008 0.000248 -0.002891 0.000019
> > 0.000164 -0.002697 -0.000000 0.000091 -0.000025 -0.000002 0.000919 -0.000414 0.000337 0.000521
> > 0.000042 0.000141 0.000063 0.000237 -0.000066 -0.000287 -0.000014 0.000004 -0.000005 0.000043
> > -0.000064 -0.000203 -0.000019 -0.000263 -0.000759 0.000000 0.000209 -0.000252 0.000002 0.000075
> > -0.000260 0.000018 0.000154 0.003075 0.000001 -0.000164 -0.000093 -0.000038 0.004399 0.006622
> > 0.000212 0.001028 0.000994 -0.000000 0.000042 0.000054 0.000034 -0.012595 0.004790 -0.000029
> > -0.000124 0.006728 -0.000001 -0.000017 0.000218 -0.000007 0.002552 0.000069 0.000020 0.000146
> > -0.001972 -0.000000 0.000020 0.000028 0.000007 -0.000613 -0.002186 0.000001 0.000004 -0.000132
> > 0.000000 -0.000014 -0.000021 -0.000003 0.000003 0.001040 -0.000002 -0.000003 0.000801 0.000000
> > -0.000019 0.000010 -0.000001 -0.000057 0.000401 0.000003 0.000037 -0.000162 -0.000000 0.000002
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> >
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> >
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> > -0.000022 0.004217 0.003326 0.016535 0.001645 -0.010895 0.000001 0.000112 -0.000328 0.000002
> > -0.003795 0.002952 0.000000 0.000006 -0.000028 0.000000 -0.000004 -0.000005 -0.000000 0.000002
> > 0.000032 -0.000000 0.000112 -0.000495 -0.000000 0.000012 0.000009 0.000001 -0.000352 0.000018
> >
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> > -0.000035 0.000115 -0.000000 0.000020 0.000031 0.000002 -0.000237 -0.000203 -0.000017 -0.000008
> > -0.000012 -0.000022 0.000054 0.000350 0.000007 0.000759 -0.000367 0.001248 -0.000013 -0.000047
> > 0.000057 0.000393 0.000000 0.000002 0.000211 0.000000 -0.000003 -0.000007 0.000000 0.000025
> > -0.000104 0.000004 0.000014 -0.000959 -0.000000 -0.000012 0.000047 -0.000001 -0.000017 0.000243
> > -0.000003 -0.000044 0.000152 -0.000000 0.000004 0.000018 0.000001 -0.000017 -0.000191 -0.000020
> > -0.000172 0.000523 0.000000 -0.000028 0.000009 -0.000003 0.000984 0.000004 0.001018 0.000169
> > -0.003849 -0.000000 -0.000045 0.000089 0.000001 -0.001810 0.001269 -0.021739 -0.001785 0.010689
> > -0.000001 0.000014 0.000325 0.000020 -0.002650 -0.003992 0.995954 0.025373 -0.021167 0.000001
> > -0.000389 0.000260 -0.000010 0.004928 -0.001728 -0.004918 -0.001137 0.008025 0.000001 -0.000123
> > -0.000138 -0.000018 0.001902 0.003985 0.002235 0.000023 -0.002633 0.000000 -0.000144 0.000050
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> > 0.001111 -0.001075 0.000000 0.000006 -0.000018 0.000000 -0.000002 -0.000005 -0.000000 0.000009
> > 0.000050 0.000000 -0.000116 0.000502 -0.000000 0.000012 -0.000006 0.000001 -0.000315 -0.000123
> >
> > 15.1 2 -1.2541 -22.4882 -0.102412 0.204521 0.251175 0.000415 -0.016647 -0.045740 0.000333 -0.011190 -0.055112 -0.058891
> > 0.115824 0.161941 -0.000102 -0.025864 0.055095 -0.000000 -0.028624 0.029391 0.047664 0.011218
> > 0.015554 -0.023064 0.005434 0.012557 0.000142 0.004975 -0.000261 -0.001281 -0.000007 0.000421
> > 0.000035 -0.001811 -0.063890 0.135021 -0.017991 0.000254 -0.064518 -0.013752 -0.000265 0.059478
> > 0.019771 -0.046773 0.089519 0.006024 -0.000196 0.016990 0.037346 -0.000030 -0.022546 0.038502
> > -0.115616 0.239570 -0.011791 0.000034 -0.047102 0.052708 -0.000040 0.031807 -0.023099 -0.010291
> > 0.016800 0.040384 -0.000053 0.005969 0.011395 -0.000106 0.031313 -0.002083 -0.001781 0.005084
> > -0.020591 -0.000008 0.000434 0.002269 0.000087 -0.016392 -0.012010 -0.000760 0.001250 0.005123
> > -0.000001 -0.000239 0.000550 0.000002 -0.011179 0.009548 -0.000141 0.000243 0.005494 0.000000
> > -0.000266 0.000097 -0.000030 0.004094 0.006116 -0.000068 0.000242 0.002242 -0.000001 0.000011
> > 0.000175 -0.000008 0.003603 -0.001086 -0.000140 -0.000108 0.005985 -0.000001 0.000039 0.000210
> > -0.000010 0.001807 0.001562 -0.000359 0.000763 -0.009639 -0.000001 0.000293 -0.000148 0.000012
> > -0.005042 0.001293 -0.132364 0.283712 0.320888 -0.000268 0.097307 -0.035261 -0.000169 0.056732
> > -0.017881 -0.000019 0.000224 -0.001312 -0.000000 0.000022 0.000029 0.000003 -0.000353 -0.000451
> >
> > 16.1 2 -1.1908 -22.4353 -0.081881 0.162576 0.224451 0.000170 0.040183 -0.045053 0.000229 0.014732 -0.059011 -0.093981
> > 0.186096 0.237833 -0.000179 -0.031787 0.083860 -0.000022 -0.038468 0.043847 0.039744 0.006374
> > 0.027390 -0.010969 0.002744 0.004911 0.000280 0.006245 -0.000289 -0.001866 -0.000079 -0.000425
> > -0.000273 -0.003183 -0.090119 0.184790 0.012247 0.000375 -0.075575 -0.040285 -0.000155 0.038528
> > 0.014456 -0.040113 0.075361 0.038710 -0.000256 0.058272 0.011694 -0.000070 -0.028299 0.051934
> > 0.036653 -0.073274 -0.063752 -0.000523 0.175576 -0.050225 0.000157 -0.064407 0.026631 -0.006837
> > 0.011557 0.059049 -0.000050 0.008569 0.007190 -0.000001 0.032056 -0.038094 -0.002030 0.007295
> > -0.049051 -0.000008 0.000551 0.002359 0.000109 -0.005039 -0.034798 -0.001184 0.003012 -0.006851
> > -0.000002 -0.000045 0.000562 -0.000020 -0.008801 0.016029 -0.000356 0.000664 0.012708 -0.000000
> > -0.000532 0.000493 -0.000040 0.003991 0.009117 -0.000332 0.001060 0.002837 -0.000000 -0.000019
> > 0.000096 -0.000004 0.003896 -0.002389 -0.000232 0.000506 0.008975 -0.000002 0.000292 0.000461
> > -0.000008 0.000558 0.002011 -0.000466 0.001566 -0.009945 -0.000002 0.000503 0.000126 0.000007
> > -0.007293 0.005793 0.142215 -0.306448 -0.346195 0.000223 -0.086382 0.036730 0.000113 -0.045001
> > 0.019303 -0.000376 0.001166 -0.001456 -0.000001 -0.000040 0.000304 0.000003 -0.000243 -0.000607
> >
> > 17.1 2 -1.1739 -20.8691 0.000559 -0.000853 -0.003935 -0.000001 -0.000137 0.000217 -0.000007 0.000264 0.001246 0.000235
> > -0.000233 -0.002758 0.000001 -0.000097 -0.000213 0.000001 0.001029 -0.001454 -0.000280 -0.000178
> > -0.000040 0.000800 0.000371 -0.000123 0.001595 -0.004747 0.008695 -0.003310 0.008832 -0.003519
> > 0.001643 -0.003542 0.000391 -0.000771 0.001616 -0.000001 0.000346 -0.000051 0.000009 -0.001975
> > -0.000677 -0.000198 0.000287 0.002023 0.000002 -0.000326 -0.000383 0.000011 0.000697 -0.004370
> > -0.000018 -0.000012 0.002594 0.000003 -0.000624 -0.000152 -0.000009 0.002840 -0.000382 -0.001082
> > 0.003505 -0.014408 0.000002 0.000381 -0.001272 -0.000001 -0.004377 0.005850 -0.005248 0.010370
> > 0.018727 0.000016 0.000769 -0.005741 -0.000029 -0.000858 0.011851 -0.007720 0.017199 0.029780
> > 0.000038 -0.003065 -0.009332 0.000002 0.007472 -0.009247 -0.025633 0.052103 -0.006790 0.000134
> > -0.020946 -0.022004 0.000039 0.015709 -0.026428 -0.114379 0.231001 0.049665 0.000405 0.024270
> > -0.147391 -0.000250 -0.016317 0.092787 -0.026031 0.052850 -0.005910 -0.000034 0.027156 -0.013929
> > 0.000115 -0.007633 -0.029046 -0.008089 0.018115 0.029568 0.000008 0.005778 -0.008107 0.000037
> > -0.003357 -0.009744 -0.000359 0.000575 0.002102 -0.000000 0.000175 -0.000118 -0.000001 0.000349
> > -0.000278 -0.191352 0.409170 0.479061 -0.000363 -0.022204 0.132574 -0.000215 -0.013098 0.078424
> >
> > 18.1 2 -1.0569 -22.1297 -0.144174 0.296161 0.395296 0.000318 -0.008760 0.015965 0.000325 -0.010089 -0.023544 0.128060
> > -0.263741 -0.321841 0.000052 0.049220 -0.067012 -0.000065 0.047814 -0.029864 0.106010 0.012320
> > -0.002537 0.001024 -0.017544 -0.011707 -0.008963 -0.008447 -0.001995 0.001315 -0.001983 0.000166
> > -0.006030 -0.001841 0.016431 -0.032900 -0.025756 -0.000476 -0.028569 0.163136 0.000005 0.006956
> > -0.009813 0.072254 -0.146091 -0.026801 0.000172 -0.062896 0.019743 -0.000152 0.049920 -0.008847
> > -0.014791 0.036920 -0.009353 -0.000598 0.091646 0.070216 0.000259 -0.055581 -0.014839 0.041301
> > -0.081763 -0.044726 0.000116 -0.024012 -0.012491 0.000074 -0.018225 -0.003127 0.026590 -0.052133
> > -0.020131 0.000027 -0.000506 -0.011102 -0.000015 0.010471 -0.007172 0.015150 -0.029134 -0.025059
> > -0.000017 0.009065 -0.003276 -0.000030 0.012405 -0.001748 0.006903 -0.013541 -0.006359 0.000007
> > 0.003626 -0.005952 0.000021 -0.004339 -0.002764 0.001963 -0.003779 -0.007657 0.000025 0.001370
> > -0.009130 0.000010 -0.001411 -0.001664 0.006489 -0.012436 -0.006590 0.000023 -0.001604 -0.006269
> > -0.000002 0.000750 -0.000327 0.013204 -0.025667 -0.015387 0.000037 -0.008498 -0.004005 0.000010
> > -0.003250 0.000189 0.034510 -0.072163 -0.107999 -0.000040 -0.005350 0.018343 -0.000011 -0.007717
> > 0.014157 -0.004660 0.010117 0.011630 -0.000006 -0.000380 0.002077 -0.000005 0.000000 0.001353
> >
> > 19.1 2 -1.0101 -22.3112 -0.027394 0.055924 0.078247 0.000076 -0.010863 0.009013 0.000068 -0.004364 -0.002548 0.036626
> > -0.077657 -0.082094 0.000142 -0.004575 -0.038352 0.000029 0.004267 -0.012618 0.023078 0.003305
> > -0.008448 0.000227 0.036644 0.003535 0.036756 -0.000410 0.022092 0.002275 0.024116 0.001348
> > 0.043929 0.004410 0.019904 -0.043099 -0.023712 -0.000169 -0.000376 0.049877 0.000009 -0.000465
> > -0.002919 -0.016245 0.032242 0.046045 0.000218 -0.041236 -0.028649 0.000057 -0.010837 -0.008080
> > -0.008428 0.019757 0.000956 -0.000106 0.027285 -0.000990 0.000035 -0.007682 -0.002104 -0.071734
> > 0.145860 0.099711 0.000096 0.011684 -0.047451 0.000112 -0.007813 -0.032285 -0.120007 0.236826
> > 0.133615 0.000095 -0.005110 -0.017573 0.000043 0.016127 -0.029394 -0.089265 0.178401 0.090973
> > 0.000214 -0.051984 -0.019375 -0.000022 0.003811 0.003453 -0.062060 0.119964 0.082948 -0.000021
> > -0.033389 0.041062 0.000009 -0.007944 0.005786 -0.027143 0.056465 0.036212 -0.000221 -0.015666
> > 0.083642 -0.000012 -0.003348 0.006715 -0.066611 0.129411 0.088958 -0.000214 0.018060 0.054065
> > -0.000030 0.000519 0.009957 -0.098411 0.196193 0.115637 -0.000158 0.054727 -0.000843 -0.000037
> > 0.001278 0.011380 0.013790 -0.029847 -0.037825 0.000004 -0.002684 0.001811 0.000003 -0.002330
> > 0.001952 0.037887 -0.083029 -0.093519 0.000035 0.001819 -0.012474 0.000018 0.001424 -0.006771
> >
> > 20.1 2 -0.9322 -22.2023 -0.010733 0.020788 0.032576 0.000212 -0.054304 0.000772 0.000098 -0.022926 -0.000442 0.040599
> > -0.086507 -0.105310 0.000481 -0.063586 -0.078114 0.000088 -0.006097 -0.017972 0.007892 0.001360
> > -0.038595 -0.006537 0.073070 0.004854 -0.009823 0.001718 -0.026269 -0.004689 -0.029600 -0.005409
> > -0.013621 0.003573 0.062020 -0.134570 -0.082775 -0.000185 -0.000088 0.057990 0.000016 -0.007027
> > -0.000300 -0.099284 0.199708 0.156514 0.000352 -0.081186 -0.039247 0.000055 -0.000680 -0.024364
> > -0.040393 0.088977 0.062567 -0.000030 0.065154 -0.068144 0.000059 0.009899 -0.024249 -0.123803
> > 0.256201 0.142318 -0.000216 0.033150 0.036874 0.000064 -0.023811 0.008482 -0.031422 0.063227
> > 0.049417 -0.000227 -0.014143 0.097286 -0.000109 0.000668 0.036917 0.032361 -0.064603 -0.034610
> > -0.000149 -0.008348 0.057797 0.000022 -0.003940 -0.003152 0.059568 -0.115372 -0.091148 -0.000048
> > 0.030643 -0.016000 -0.000004 0.006970 -0.006003 0.038527 -0.081232 -0.049914 0.000221 0.016850
> > -0.084674 0.000039 0.002030 -0.014202 0.065545 -0.127334 -0.098809 0.000154 -0.023328 -0.029254
> > 0.000036 -0.005476 -0.006870 0.038712 -0.077294 -0.041633 -0.000157 -0.010003 0.062301 -0.000033
> > 0.008789 0.001850 0.034195 -0.075982 -0.087458 0.000041 -0.002550 -0.009509 -0.000001 -0.000784
> > -0.000909 -0.034825 0.077213 0.087659 -0.000011 -0.000091 0.003371 -0.000005 -0.000234 0.001932
> >
> > 21.1 2 -0.8859 -20.9965 0.001724 -0.003410 -0.005416 -0.000020 0.005747 -0.001802 -0.000013 0.002925 -0.000102 -0.001614
> > 0.003259 0.005933 -0.000053 0.005498 0.010152 -0.000004 -0.001396 0.002676 -0.002139 -0.000599
> > 0.004014 0.000458 0.011833 0.010395 -0.068445 -0.008765 -0.065214 -0.016778 0.058183 0.016065
> > 0.071517 0.014990 -0.005926 0.012946 0.008499 0.000014 0.000127 -0.004710 -0.000004 0.001698
> > -0.000349 0.004735 -0.008745 -0.020325 -0.000004 -0.000436 0.002362 -0.000024 -0.000737 0.009397
> > 0.002507 -0.005735 -0.005248 0.000014 -0.004496 0.001034 -0.000009 -0.000088 0.002024 -0.005613
> > 0.009899 0.016043 0.000094 -0.020352 -0.010224 -0.000047 0.011146 0.003448 -0.002165 0.004715
> > -0.001420 0.000357 -0.108578 -0.009473 0.000102 -0.030527 -0.003027 0.117016 -0.237222 -0.158894
> > -0.000160 -0.017830 0.071238 0.000038 -0.015394 0.002290 0.115790 -0.228177 -0.173916 0.000172
> > 0.010958 -0.071074 0.000009 0.004341 -0.008283 0.006233 -0.013212 -0.008684 0.000383 -0.098768
> > -0.028774 0.000059 -0.012990 -0.006241 -0.100043 0.196742 0.158925 -0.000134 -0.021334 0.067625
> > -0.000037 -0.001025 0.013177 -0.111747 0.227202 0.150694 0.000191 -0.002028 -0.060125 0.000041
> > -0.014870 0.002444 -0.001645 0.003636 0.004689 0.000003 -0.000653 -0.000201 0.000002 -0.000113
> > -0.000274 -0.004701 0.010535 0.011419 0.000070 -0.019740 -0.003654 0.000015 -0.004116 -0.000954
> >
> > 22.1 2 -0.8565 -21.7691 0.010593 -0.025771 -0.017949 0.000481 -0.112934 -0.043320 0.000236 -0.054550 -0.024806 0.012263
> > -0.028380 -0.031387 0.000502 -0.091633 -0.053669 0.000130 -0.023487 -0.011206 -0.028697 -0.004003
> > -0.069443 -0.023418 -0.020300 -0.003961 -0.015701 -0.001813 0.028225 0.002088 0.041952 0.006913
> > -0.011088 -0.000846 0.077233 -0.167062 -0.122501 0.000108 -0.022897 -0.000773 0.000020 -0.007997
> > -0.000898 -0.086131 0.175326 0.118563 -0.000240 -0.011169 0.076804 -0.000157 0.012340 0.030220
> > -0.069679 0.154642 0.087137 -0.000095 0.098531 -0.086209 0.000091 0.013454 -0.032774 0.034482
> > -0.071547 -0.034249 -0.000434 0.019062 0.129725 -0.000137 0.019407 0.027720 0.093455 -0.183620
> > -0.161255 0.000042 0.013079 -0.036721 0.000055 -0.016894 -0.004804 0.019165 -0.041642 -0.007546
> > 0.000063 0.046598 -0.066075 0.000057 -0.008437 -0.010419 -0.052241 0.103985 0.068111 0.000172
> > -0.031340 -0.023692 -0.000012 0.008397 -0.003390 -0.055735 0.118241 0.097232 -0.000230 -0.027797
> > 0.096877 -0.000092 -0.004370 0.032418 -0.073578 0.145485 0.100920 -0.000088 0.034694 -0.002972
> > 0.000029 -0.001763 -0.007549 0.007722 -0.016684 -0.011961 0.000385 -0.024444 -0.103745 0.000070
> > 0.002226 -0.025531 0.038877 -0.087035 -0.102475 0.000007 0.010727 -0.014613 -0.000033 0.007715
> > -0.002950 0.040513 -0.090570 -0.105321 -0.000013 -0.003654 0.007324 -0.000005 -0.001413 0.002727
> >
> > 23.1 2 -0.7727 -21.1709 -0.007512 0.018860 0.010746 -0.000736 0.165977 0.069149 -0.000390 0.085759 0.043319 0.020612
> > -0.041221 -0.067323 -0.000207 0.054437 0.003249 -0.000109 0.024220 0.003511 0.040575 0.007879
> > 0.092654 0.038515 0.083973 0.018730 -0.036741 0.003755 0.028829 0.000286 0.029683 0.000319
> > -0.038252 -0.000001 -0.067622 0.145974 0.119814 -0.000507 0.053668 0.083472 -0.000111 0.019907
> > 0.016144 -0.012912 0.023619 0.037454 0.000780 -0.101619 -0.138871 0.000191 -0.008207 -0.049342
> > 0.058161 -0.131995 -0.053441 0.000475 -0.103215 -0.018227 0.000001 -0.020165 0.010346 -0.095808
> > 0.201726 0.120681 -0.000200 -0.002357 0.078644 0.000020 -0.035200 0.038379 0.050100 -0.099712
> > -0.096931 -0.000255 -0.018243 0.107592 -0.000216 -0.002698 0.075948 0.051035 -0.107099 -0.061248
> > 0.000008 0.040360 -0.039665 0.000153 -0.020481 -0.029406 -0.040527 0.083368 0.039725 0.000327
> > -0.032339 -0.072445 -0.000001 0.019876 -0.018013 -0.066329 0.142236 0.143227 -0.000250 -0.016416
> > 0.092309 -0.000126 -0.008184 0.046325 -0.041263 0.085092 0.038572 0.000025 0.054656 -0.059522
> > 0.000120 -0.014204 -0.025150 0.052375 -0.110605 -0.051616 0.000233 -0.025189 -0.051293 -0.000036
> > 0.032052 -0.020716 -0.024305 0.055852 0.060507 0.000152 -0.029357 -0.010118 0.000106 -0.018700
> > -0.004882 0.041934 -0.094351 -0.115868 -0.000068 -0.004467 0.025157 -0.000030 -0.001797 0.010903
> >
> > 24.1 2 -0.7156 -20.3466 -0.044746 0.098530 0.129377 -0.000095 -0.090056 0.276782 -0.000090 -0.033594 0.167725 -0.077088
> > 0.166344 0.234039 0.000639 -0.074626 -0.095357 0.000248 -0.030686 -0.028674 0.184973 0.044424
> > -0.098099 -0.036151 -0.026441 -0.019054 0.022007 0.014095 -0.021520 -0.009647 0.028744 0.007368
> > -0.032452 -0.009100 0.085599 -0.187796 -0.147979 0.000409 -0.004642 -0.070979 0.000140 -0.025647
> > -0.024249 0.000537 0.001541 0.005892 0.000018 0.137485 -0.136793 0.000179 0.006771 -0.062158
> > 0.055905 -0.121114 -0.070032 -0.000274 -0.038230 0.142814 -0.000125 -0.006631 0.038716 -0.005584
> > 0.016865 -0.034851 -0.000140 0.062963 -0.020548 0.000070 -0.003687 -0.015035 0.000296 -0.002375
> > 0.000882 -0.000258 0.048222 0.039343 -0.000175 0.026903 0.029689 -0.005954 0.011810 0.012024
> > -0.000128 -0.002905 0.044223 -0.000014 0.002529 0.002979 0.021875 -0.043084 -0.047782 0.000031
> > -0.009525 -0.002189 0.000018 -0.002009 -0.004611 -0.013916 0.029955 0.032598 0.000139 -0.054973
> > 0.006933 0.000018 -0.017017 0.009835 -0.029530 0.060743 0.037848 0.000063 0.017595 -0.036624
> > 0.000075 -0.008665 -0.015784 0.028501 -0.059481 -0.031334 0.000107 0.002760 -0.038383 -0.000013
> > 0.019499 -0.015511 -0.016050 0.038331 0.039045 -0.000145 -0.002610 0.053480 -0.000028 -0.008615
> > 0.027683 0.008324 -0.018941 -0.022967 0.000035 -0.017782 0.005316 0.000011 -0.007012 0.002954
> >
> > 25.1 2 -0.6919 -20.4295 -0.007522 0.016485 0.020514 0.000336 -0.102479 0.031583 0.000178 -0.054335 0.019662 -0.028952
> > 0.061539 0.092538 -0.000096 0.008083 0.025649 -0.000017 -0.002732 0.014342 0.024079 0.005686
> > -0.057750 -0.025170 0.043496 0.017273 -0.104840 -0.025681 0.081423 0.026890 -0.082972 -0.039010
> > 0.061929 0.027595 0.030900 -0.066808 -0.057915 0.000470 -0.025616 -0.095900 0.000129 -0.020430
> > -0.020691 0.031702 -0.064060 -0.047572 -0.000197 0.051134 0.012891 0.000091 -0.013425 -0.016638
> > -0.002646 0.007632 -0.003109 -0.000369 0.028137 0.075807 -0.000077 0.012714 0.013103 -0.017127
> > 0.036485 0.014553 0.000499 -0.079480 -0.084184 0.000252 -0.039915 -0.042224 -0.012077 0.025095
> > -0.009124 0.000489 -0.184046 0.028145 0.000059 -0.034833 0.015457 0.093992 -0.192916 -0.183627
> > 0.000291 0.004758 -0.094926 0.000194 -0.027046 -0.035656 -0.077308 0.156648 0.138714 0.000504
> > -0.016658 -0.141519 0.000032 0.020602 -0.028068 -0.035425 0.077412 0.078871 -0.000717 0.170344
> > 0.066938 -0.000219 0.041947 0.029792 0.072259 -0.143120 -0.141665 -0.000209 0.027464 0.039943
> > -0.000053 0.007663 0.008871 -0.040930 0.082598 0.100303 -0.000379 -0.005001 0.132375 -0.000110
> > -0.002586 0.040519 0.004153 -0.009896 -0.008245 -0.000149 0.016164 0.025133 -0.000076 0.008402
> > 0.011607 0.019948 -0.045076 -0.059612 -0.000271 0.055908 0.032993 -0.000121 0.024328 0.015512
> >
> > 26.1 2 -0.6740 -20.5346 -0.009528 0.021375 0.023170 -0.000594 0.101904 0.148040 -0.000351 0.063699 0.091985 -0.004858
> > 0.010423 0.019965 0.000410 -0.047371 -0.062769 0.000129 -0.015736 -0.017995 0.089759 0.026349
> > 0.027965 0.017627 0.002085 0.004435 0.029657 0.009810 0.064208 0.038962 -0.013592 0.005983
> > 0.115903 0.048750 0.001896 -0.006426 -0.002619 -0.000351 0.041293 0.074581 -0.000082 0.011861
> > 0.014862 -0.051801 0.105475 0.109044 0.000266 -0.018675 -0.056988 0.000083 -0.003714 -0.016248
> > 0.031261 -0.071045 -0.024494 0.000577 -0.069652 -0.068458 0.000051 -0.016691 -0.004663 0.012528
> > -0.025439 -0.025051 -0.000499 0.015745 0.163398 -0.000091 -0.001680 0.036077 0.067163 -0.136154
> > -0.106163 0.000349 -0.045425 -0.080422 0.000124 -0.009437 -0.036095 -0.020523 0.042825 0.017384
> > -0.000045 0.105091 -0.089389 -0.000096 0.037214 -0.004395 -0.044582 0.085574 0.112186 -0.000493
> > 0.089429 0.076322 -0.000092 0.006937 0.023493 0.076483 -0.166746 -0.166546 -0.000099 0.103078
> > -0.062101 0.000056 0.034445 -0.048061 0.021734 -0.047670 -0.021615 -0.000039 -0.134745 0.142077
> > -0.000105 -0.006334 0.039829 -0.085765 0.177471 0.152974 0.000434 -0.100726 -0.043720 0.000184
> > -0.056427 -0.003516 -0.010931 0.026335 0.024766 0.000222 -0.030813 -0.020797 0.000141 -0.020101
> > -0.008908 -0.040499 0.092421 0.118293 0.000035 0.041129 -0.048003 0.000027 0.019232 -0.025669
> >
> > 27.1 2 -0.6220 -20.7042 0.005698 -0.008446 -0.040008 0.000778 -0.235443 -0.001592 0.000438 -0.148051 0.017104 -0.015482
> > 0.034654 0.046711 -0.000950 0.188179 0.087429 -0.000364 0.078409 0.035009 -0.009207 -0.011250
> > 0.024759 0.015291 0.104955 0.032667 0.066641 0.035958 0.041138 0.022820 0.081449 0.042082
> > 0.030210 0.024987 -0.009479 0.020740 0.061311 0.000367 0.099378 -0.192084 0.000037 0.006657
> > -0.029370 0.058666 -0.122279 -0.119268 0.000347 -0.095213 -0.008983 0.000411 -0.045685 -0.089848
> > -0.043724 0.100684 0.110424 -0.000722 0.046711 0.135870 -0.000115 0.048352 -0.011533 -0.054450
> > 0.117101 0.062434 0.000425 -0.107710 -0.018860 0.000380 -0.090440 -0.027464 0.040012 -0.080760
> > -0.085849 -0.000293 -0.011625 0.116598 -0.000228 0.033171 0.044501 -0.028269 0.058546 0.047024
> > -0.000320 0.133326 -0.025123 -0.000110 0.050231 -0.012253 -0.016199 0.032005 0.033879 -0.000517
> > 0.090072 0.081971 -0.000114 0.025335 0.012780 0.033444 -0.073362 -0.055548 0.000282 -0.046416
> > -0.044933 0.000132 -0.019594 -0.023281 -0.039528 0.079478 0.085552 0.000375 -0.090311 -0.032918
> > 0.000151 -0.042102 -0.007589 0.010761 -0.024083 -0.003674 0.000514 -0.104467 -0.062807 0.000059
> > -0.017795 -0.000700 0.034727 -0.079765 -0.103980 -0.000491 0.093242 0.022843 -0.000287 0.050164
> > 0.014144 -0.011733 0.027751 0.031420 0.000144 -0.018676 -0.027328 0.000080 -0.007935 -0.017210
> >
> > 28.1 2 -0.6021 -19.7380 -0.017548 0.031607 0.112459 -0.000123 0.129085 -0.234484 -0.000003 0.077556 -0.181040 0.007652
> > -0.015818 -0.043910 0.000276 -0.117778 0.001202 0.000065 -0.045298 0.000169 -0.115869 -0.032121
> > -0.153345 -0.094973 0.031120 0.020700 0.040167 0.015337 0.053066 0.028305 0.065366 0.035390
> > 0.033681 0.022091 0.019345 -0.035756 -0.111877 0.000519 -0.284440 0.067544 0.000263 -0.068232
> > -0.011615 0.025458 -0.052805 -0.028890 -0.000291 0.110407 -0.054613 -0.000425 0.058070 0.057664
> > 0.057678 -0.133337 -0.188154 -0.000552 0.051152 0.058971 -0.000003 -0.063664 0.061507 -0.031042
> > 0.063212 0.125899 0.000302 -0.021624 -0.089550 -0.000016 0.014534 -0.012757 0.018755 -0.037832
> > -0.058649 -0.000313 -0.022299 0.132882 -0.000070 -0.005552 0.029514 -0.004482 0.008209 0.014797
> > -0.000288 0.102768 -0.005246 -0.000133 0.032428 0.012453 -0.020979 0.042130 0.054679 -0.000284
> > 0.078590 0.018766 -0.000108 0.029961 0.007065 0.016605 -0.035948 -0.021178 0.000121 -0.010711
> > -0.027694 0.000060 -0.004794 -0.014709 -0.026067 0.051974 0.071155 0.000334 -0.075020 -0.034949
> > 0.000117 -0.034589 -0.004192 0.007568 -0.017115 -0.020856 0.000391 -0.095298 -0.032031 0.000065
> > -0.030437 0.010245 -0.046389 0.106081 0.142877 0.000116 -0.101649 0.065656 0.000069 -0.054310
> > 0.031745 -0.001983 0.005739 -0.000802 0.000043 -0.005934 -0.007915 0.000032 -0.002370 -0.007480
> >
> > 29.1 2 -0.5455 -19.8736 0.010593 -0.022606 -0.028637 -0.000041 -0.082837 -0.092096 -0.000018 -0.055516 -0.071117 0.007960
> > -0.019761 0.002817 0.000462 -0.057225 -0.139189 0.000159 -0.024778 -0.057117 -0.073381 -0.030462
> > 0.144291 0.082786 -0.149632 -0.088430 0.033089 0.020440 0.075980 0.041634 0.032544 0.014074
> > 0.047096 0.028285 -0.016260 0.025588 0.052161 -0.001344 0.174548 0.136063 -0.000642 0.093092
> > 0.060764 -0.016615 0.032822 0.057800 -0.000186 0.074616 -0.082348 -0.000113 0.018112 -0.019186
> > -0.023325 0.057978 0.016048 -0.000815 0.033182 0.112499 -0.000290 0.015708 0.041717 0.011478
> > -0.020411 -0.050240 -0.000529 0.219924 -0.107408 -0.000256 0.101416 -0.043952 -0.016633 0.033596
> > 0.035281 -0.000594 0.059374 0.131271 -0.000132 0.002837 0.038881 0.023229 -0.049169 -0.032699
> > -0.000461 0.010927 0.138941 -0.000161 0.000456 0.050274 -0.013421 0.029755 0.026521 0.000356
> > 0.056085 -0.165889 0.000021 0.041956 -0.045101 -0.011002 0.026040 0.039474 -0.000323 0.119559
> > -0.010139 -0.000198 0.046169 0.018152 -0.004385 0.010098 -0.000940 0.000185 -0.087362 0.022588
> > 0.000142 -0.036618 -0.010843 -0.007371 0.015846 0.023148 0.000425 -0.098382 -0.045318 0.000195
> > -0.040246 -0.027521 0.012366 -0.027550 -0.044951 -0.000703 0.081185 0.057261 -0.000419 0.046902
> > 0.033257 0.016024 -0.035784 -0.056642 -0.000341 0.057361 0.052769 -0.000182 0.031537 0.027520
> >
> > 30.1 2 -0.5252 -20.6509 0.011647 -0.025455 -0.068801 0.000378 0.097264 0.153345 0.000255 0.069262 0.112843 -0.002519
> > 0.003954 0.020319 0.000863 -0.071375 -0.029269 0.000439 -0.033333 -0.008217 0.085787 0.039299
> > 0.029808 0.028477 -0.012669 0.000563 0.068670 0.036584 0.044388 0.019484 0.077008 0.045281
> > 0.081184 0.054768 0.009405 -0.023452 -0.019518 0.000263 0.050244 0.058109 0.000206 0.008422
> > 0.020571 -0.007113 0.018052 -0.000730 -0.000486 0.077582 0.218290 0.000043 0.022229 0.050653
> > -0.027080 0.060351 0.107349 0.001713 -0.072612 -0.195628 0.000475 0.028161 -0.083952 0.035771
> > -0.077503 -0.091452 0.000907 -0.079726 -0.181404 0.000307 -0.032634 -0.051157 -0.020975 0.041641
> > 0.054144 0.000130 -0.102590 0.081457 0.000024 -0.028464 0.030288 -0.005139 0.010472 0.029412
> > -0.000462 0.114304 0.044223 -0.000190 0.050579 0.015061 -0.000721 0.003040 -0.000637 -0.000237
> > 0.085093 -0.001591 -0.000093 0.047033 -0.012813 -0.029826 0.070807 0.076521 0.000511 -0.093705
> > -0.073395 0.000124 -0.049470 0.006353 0.000154 0.001403 0.010631 0.000663 0.003326 -0.214900
> > 0.000278 -0.026611 -0.063333 0.011095 -0.024128 -0.018286 -0.000298 -0.090785 0.198560 -0.000122
> > -0.038943 0.084089 0.012181 -0.030189 -0.026349 0.000927 0.002436 -0.128091 0.000543 0.005631
> > -0.075454 0.032460 -0.072770 -0.116660 -0.000053 -0.079864 0.088615 -0.000026 -0.044571 0.048447
> >
> > 31.1 2 -0.4978 -19.5746 0.002813 -0.003869 -0.042215 0.011240 0.082170 0.114669 0.008079 0.058782 0.104215 0.007683
> > -0.012965 -0.052382 0.005407 0.058726 0.138176 0.003386 0.023084 0.056710 0.075048 0.030341
> > -0.082805 -0.050803 -0.041786 -0.023444 -0.070127 -0.027871 0.110272 0.068024 0.099874 0.058114
> > -0.115795 -0.066780 0.001246 0.007642 -0.001456 0.007879 -0.097232 -0.111386 0.004125 -0.063492
> > -0.046533 0.010349 -0.015130 -0.106509 0.005386 -0.060486 0.109056 0.003125 -0.009736 0.038597
> > -0.014897 0.033492 0.074384 0.008863 -0.091662 -0.140382 0.004095 0.022688 -0.073677 -0.000006
> > -0.000061 -0.023401 0.002357 0.039727 -0.111550 0.000847 0.041702 0.022804 -0.044152 0.091589
> > 0.105104 0.000375 0.098407 0.069854 0.000235 -0.013815 0.083780 0.026962 -0.059397 -0.009217
> > 0.000527 -0.122683 0.055073 0.000523 -0.092532 -0.014108 -0.026591 0.055567 0.022881 0.000308
> > 0.093700 -0.129972 -0.000000 0.075873 -0.046234 0.045138 -0.106883 -0.052303 -0.000319 0.130539
> > 0.014445 -0.000157 0.062126 0.011533 -0.038566 0.076973 0.060332 0.000481 -0.172798 0.056630
> > 0.000355 -0.083699 -0.013281 0.027346 -0.057508 -0.052137 0.000566 0.075132 -0.165278 0.000238
> > 0.066612 -0.092648 0.012307 -0.030802 -0.028103 0.006360 0.014405 -0.128032 0.003927 0.012350
> > -0.078810 -0.018788 0.041955 0.069830 -0.000024 0.100623 -0.064143 -0.000008 0.058065 -0.039577
> >
> > 32.1 2 -0.4955 -20.0681 -0.000450 0.000868 0.002773 0.339733 0.001132 -0.002698 0.246230 0.000606 -0.001567 -0.000015
> > 0.000180 -0.001256 0.178061 0.007098 0.002725 0.107491 0.003964 0.000326 -0.001374 -0.000923
> > -0.004139 -0.002885 0.002941 0.002394 0.012274 0.004953 -0.008886 -0.005331 -0.008627 -0.005481
> > 0.012234 0.007116 -0.000171 0.000635 0.000611 0.207973 -0.004809 -0.003323 0.110171 -0.002300
> > -0.002049 0.000789 -0.001771 -0.001571 0.162312 -0.005901 -0.003554 0.093856 -0.001512 -0.002171
> > 0.000671 -0.001684 -0.001119 0.232559 0.001778 0.002684 0.116310 -0.000645 0.000450 -0.000052
> > -0.000157 0.003261 0.064929 -0.001334 0.010582 0.031370 -0.000835 0.001249 0.003425 -0.007202
> > -0.004888 0.025826 0.007279 -0.001724 0.012806 0.005111 -0.006605 -0.003273 0.007044 0.004730
> > 0.009414 0.005461 0.016387 0.006166 0.007735 0.009112 0.003891 -0.007776 -0.006520 0.005002
> > -0.011071 -0.007347 0.002177 -0.007009 -0.001433 -0.005866 0.013947 0.008331 0.003308 0.006027
> > -0.001888 0.001978 0.002188 0.001075 0.003319 -0.006752 -0.004411 0.004424 0.006588 0.004556
> > 0.002000 0.004817 0.003368 -0.002581 0.005557 0.003473 0.009251 -0.014578 0.001936 0.005196
> > -0.010353 0.003422 -0.000263 0.000672 0.000432 0.175325 -0.000635 0.001367 0.108666 -0.000515
> > 0.000950 0.003370 -0.007565 -0.012264 0.001923 0.001410 0.014146 0.001002 0.000782 0.008472
> >
> > 33.1 2 -0.4953 -19.7011 -0.007292 0.016609 0.022024 -0.024837 0.044574 0.016725 -0.018030 0.029304 0.027607 0.001506
> > 0.000480 -0.033808 -0.013700 0.117016 0.092291 -0.008137 0.060780 0.026111 0.021266 0.004964
> > -0.097939 -0.065058 0.022106 0.022440 0.137370 0.056578 -0.068916 -0.040621 -0.068689 -0.046199
> > 0.115491 0.067914 0.000141 0.008381 0.003573 -0.014342 -0.120550 -0.109019 -0.007614 -0.067022
> > -0.055001 0.015750 -0.031636 -0.070718 -0.011434 -0.116570 0.003596 -0.006657 -0.031358 -0.018369
> > 0.001193 -0.004559 0.027074 -0.016582 -0.041623 -0.050269 -0.008341 -0.003266 -0.039470 0.001297
> > -0.006280 0.023030 -0.004935 -0.009045 0.087722 -0.002367 0.000637 0.025715 0.025427 -0.054243
> > -0.014024 -0.002341 0.139374 0.005389 -0.000981 0.062862 -0.050058 -0.032611 0.069558 0.061675
> > -0.001536 0.020100 0.250255 -0.001010 0.063809 0.116870 0.041177 -0.081168 -0.080247 0.000433
> > -0.104793 -0.160360 0.000142 -0.058737 -0.042078 -0.060374 0.143716 0.092519 -0.000582 0.138344
> > -0.022947 -0.000377 0.056159 0.020560 0.027836 -0.057211 -0.033928 -0.000601 0.010624 0.079005
> > -0.000336 0.025675 0.036272 -0.022332 0.048651 0.024811 -0.000048 -0.165002 -0.040735 -0.000064
> > -0.109919 0.006905 0.003649 -0.008645 -0.012151 -0.012526 -0.008494 -0.061729 -0.007766 -0.005458
> > -0.036579 0.038649 -0.086915 -0.139707 -0.000872 0.062200 0.167536 -0.000506 0.035561 0.099750
> >
> > 34.1 2 -0.4633 -19.8056 0.000599 0.001701 -0.025253 -0.000195 0.156052 -0.056293 -0.000213 0.110759 -0.007398 -0.017098
> > 0.036716 0.092483 0.000462 -0.035507 -0.052336 0.000235 -0.021346 -0.019653 -0.044794 -0.040372
> > -0.069303 -0.059568 -0.006935 -0.036159 0.008619 0.010251 -0.014113 -0.005081 -0.043946 -0.030021
> > -0.004513 0.000031 -0.002909 0.010982 -0.011072 0.000306 -0.138607 0.077961 0.000177 -0.039891
> > 0.013984 0.021077 -0.043747 -0.052038 0.000428 0.041944 -0.105839 0.000739 -0.040331 -0.139706
> > -0.038670 0.107833 0.091503 0.001077 -0.327806 0.144872 -0.000041 0.042403 0.002780 -0.006742
> > 0.017657 -0.070446 0.000049 0.023426 -0.007450 0.000285 -0.057330 -0.020315 0.010709 -0.024428
> > -0.007657 0.000135 -0.042793 0.016118 -0.000131 0.023915 0.032054 0.003053 -0.005839 -0.032659
> > -0.000007 0.047708 -0.037361 -0.000004 0.030289 -0.023464 -0.000535 -0.000465 0.005459 -0.000095
> > -0.008574 0.042301 0.000025 -0.019601 0.011897 0.001326 -0.004287 -0.008303 0.000046 -0.042724
> > 0.028590 0.000088 -0.021397 -0.005556 0.002311 -0.003317 -0.015330 -0.000263 0.059124 0.032774
> > -0.000121 0.026467 0.015902 -0.006198 0.012084 0.039344 -0.000009 0.016662 -0.006066 -0.000056
> > 0.021453 0.000785 0.072357 -0.166558 -0.259614 -0.000848 0.409191 -0.176715 -0.000507 0.253377
> > -0.114931 -0.008134 0.018444 0.029748 0.000187 -0.017945 -0.038916 0.000108 -0.009526 -0.022962
> >
> > 35.1 2 -0.4555 -19.5327 0.000588 -0.003974 0.014951 -0.000050 -0.000805 -0.001179 -0.000002 -0.001652 -0.011590 -0.011634
> > 0.023530 0.050754 0.000441 -0.036179 -0.093515 0.000163 -0.008142 -0.041253 -0.002255 0.002440
> > 0.035872 0.026341 0.083039 0.052993 0.159145 0.108330 0.080322 0.072678 -0.129806 -0.102476
> > -0.150288 -0.120330 0.009352 -0.026642 -0.028790 -0.000450 0.052347 0.071510 -0.000214 0.032762
> > 0.028296 0.013002 -0.026894 -0.032712 -0.000506 0.069815 0.091947 -0.000246 0.052923 0.023078
> > -0.004232 0.006677 0.027456 -0.000023 0.037490 -0.038459 0.000122 -0.007419 -0.026032 -0.001854
> > 0.001954 0.017682 0.000707 -0.150895 -0.065418 0.000259 -0.071399 -0.002487 0.009801 -0.022016
> > -0.010444 0.000266 -0.097874 0.017005 0.000036 -0.023202 0.015664 0.007487 -0.020096 -0.013164
> > -0.001144 0.199898 0.178172 -0.000527 0.101074 0.074013 0.017594 -0.039649 -0.035030 -0.000065
> > 0.132939 -0.103851 -0.000046 0.041869 -0.024554 0.000578 -0.002262 -0.007460 0.000011 -0.030363
> > 0.026710 0.000002 0.005276 -0.004125 -0.016793 0.037294 0.045855 -0.001031 0.137923 0.204096
> > -0.000431 0.069571 0.073742 -0.012177 0.029206 0.024006 -0.000174 0.210426 -0.153216 -0.000140
> > 0.095162 -0.047898 -0.005244 0.012547 0.017079 0.000222 -0.046489 -0.011459 0.000129 -0.029270
> > -0.004832 -0.006715 0.015464 0.022959 -0.000010 0.033820 -0.025556 -0.000018 0.024222 -0.015129
> >
> > 36.1 2 -0.4416 -20.1441 0.007559 -0.019237 -0.021276 -0.000293 0.007023 0.025351 -0.000171 0.000257 0.006355 -0.012783
> > 0.024614 0.067198 0.000720 -0.128341 -0.099029 0.000291 -0.061018 -0.036997 0.006981 0.008902
> > 0.066819 0.052789 0.115859 0.076600 -0.018318 -0.018149 -0.154195 -0.100329 0.019465 0.027929
> > 0.030445 0.031814 0.011311 -0.032675 -0.036871 -0.000775 0.083504 0.111870 -0.000402 0.046690
> > 0.055803 0.018795 -0.038151 -0.049598 -0.001063 0.168458 0.147337 -0.000472 0.085995 0.049478
> > -0.012643 0.028031 0.037377 0.000005 0.003782 -0.032034 0.000052 0.000425 -0.029817 -0.007496
> > 0.012630 0.065781 0.001137 -0.196445 -0.166382 0.000496 -0.103259 -0.050981 0.018096 -0.039340
> > -0.045001 -0.000591 0.083422 0.135901 -0.000271 0.062089 0.037273 -0.017773 0.038901 0.003985
> > 0.000305 -0.052078 -0.042999 0.000055 -0.006396 -0.006800 0.000926 0.000052 0.011673 0.000634
> > -0.246833 0.030254 0.000349 -0.145831 0.025521 0.006929 -0.020745 -0.023476 -0.000894 0.129446
> > 0.162912 -0.000159 0.066429 -0.008639 -0.007149 0.008625 0.072571 0.000047 -0.076102 0.063240
> > -0.000138 -0.011594 0.058706 0.024118 -0.053170 -0.092743 0.000815 -0.136354 -0.121802 0.000240
> > -0.060854 -0.010433 0.003204 -0.007575 -0.009253 0.000013 0.003115 -0.035089 -0.000009 0.003518
> > -0.020684 -0.029014 0.066831 0.098871 0.000072 0.123262 -0.131638 0.000057 0.074133 -0.083588
> >
> > 37.1 2 -0.4210 -19.9710 0.003003 -0.005364 -0.026341 -0.000086 -0.007608 0.055819 -0.000077 -0.004007 0.047578 0.023535
> > -0.048711 -0.105565 -0.000847 0.069225 0.129350 -0.000393 0.027580 0.055396 0.039734 0.023059
> > -0.026934 -0.017561 -0.159651 -0.094986 0.021830 -0.005643 -0.032437 -0.007354 -0.128063 -0.072984
> > 0.066927 0.029727 -0.008477 0.026072 0.030592 0.000391 -0.022657 -0.107970 0.000175 -0.028051
> > -0.041672 -0.008881 0.022981 -0.017531 -0.000054 -0.076726 0.021666 -0.000198 -0.037099 0.060918
> > -0.003360 0.004740 0.002316 0.000100 0.027106 -0.093085 -0.000032 0.007270 -0.027958 -0.013336
> > 0.028855 0.086070 -0.000521 0.225823 -0.161554 -0.000489 0.173304 -0.077988 0.010242 -0.021703
> > -0.017328 -0.000679 -0.048389 0.236390 0.000072 -0.057624 0.008142 0.010984 -0.022878 -0.067724
> > -0.000302 0.128924 -0.049487 -0.000355 0.070340 0.033494 -0.009071 0.014872 0.095100 -0.000142
> > -0.044362 0.068823 -0.000026 -0.067006 0.061184 0.001346 -0.009206 -0.022737 -0.000277 -0.127967
> > 0.185561 0.000188 -0.034614 -0.037144 0.001870 -0.004701 0.045271 -0.000831 0.181141 0.079047
> > -0.000693 0.139809 0.080795 -0.007839 0.018672 -0.063494 0.000357 -0.107942 -0.033177 0.000292
> > -0.110072 -0.000976 -0.009003 0.018841 0.044197 0.000279 -0.073692 -0.024646 0.000177 -0.043864
> > -0.017568 -0.035128 0.081706 0.116045 0.000783 -0.041275 -0.219814 0.000503 -0.025266 -0.142524
> >
> > 38.1 2 -0.3938 -19.4123 -0.000041 0.000109 0.000100 -0.069613 -0.000257 -0.000098 -0.058488 -0.000210 -0.000065 -0.000003
> > 0.000011 -0.000015 0.015426 0.000140 0.000096 0.012068 0.000099 0.000061 0.000006 0.000004
> > -0.000025 -0.000013 -0.000098 -0.000057 -0.000066 -0.000034 0.000044 0.000018 -0.000106 -0.000084
> > 0.000059 0.000035 0.000014 -0.000029 0.000001 -0.020982 -0.000042 -0.000164 -0.011997 -0.000062
> > -0.000070 -0.000008 0.000024 -0.000036 0.055636 0.000128 0.000223 0.034241 0.000123 0.000110
> > -0.000000 -0.000003 0.000094 -0.020287 -0.000065 -0.000201 -0.010961 -0.000032 -0.000115 0.000005
> > -0.000004 -0.000065 0.109943 0.000499 0.000183 0.069230 0.000313 0.000197 0.000004 -0.000017
> > 0.000055 0.190960 0.000649 0.000688 0.119893 0.000366 0.000426 0.000004 -0.000007 -0.000023
> > 0.156440 0.000427 0.000414 0.098155 0.000254 0.000257 0.000000 -0.000003 0.000010 0.166800
> > 0.000564 0.000584 0.105577 0.000365 0.000343 -0.000006 0.000013 -0.000001 0.236368 0.000580
> > 0.000716 0.146056 0.000361 0.000471 0.000010 -0.000016 -0.000069 0.174886 0.000627 0.000624
> > 0.109433 0.000390 0.000366 -0.000006 0.000012 0.000015 0.169178 0.000414 0.000433 0.111798
> > 0.000271 0.000285 -0.000008 0.000019 0.000034 -0.028907 -0.000249 -0.000218 -0.021264 -0.000177
> > -0.000153 0.000005 -0.000012 -0.000011 0.235751 0.000574 0.000785 0.160584 0.000397 0.000537
> >
> > 39.1 2 -0.3854 -19.5696 0.010211 -0.020233 -0.068633 -0.000060 -0.007643 0.049783 -0.000043 -0.007992 0.040180 0.017728
> > -0.038790 -0.065880 -0.000123 -0.080158 0.091770 -0.000051 -0.059853 0.057513 0.025736 0.019218
> > 0.020542 0.021223 -0.026058 -0.020707 -0.066633 -0.051071 -0.062476 -0.082074 -0.080962 -0.095768
> > -0.055644 -0.045997 -0.005950 0.016741 0.013714 0.000036 0.015221 -0.025076 -0.000036 -0.002492
> > 0.007998 -0.003030 0.009989 -0.024308 -0.000527 0.059708 0.044856 -0.000386 0.020050 0.065815
> > -0.002626 0.006737 -0.015883 -0.000040 -0.010101 -0.012292 -0.000188 0.014999 0.008260 -0.021432
> > 0.046273 0.073634 0.000135 0.036184 -0.144807 -0.000150 0.046410 -0.031621 0.007282 -0.011631
> > -0.053508 -0.000471 -0.010180 0.144868 -0.000224 -0.036295 0.096375 -0.009630 0.020049 0.091777
> > 0.000473 0.030088 -0.196373 0.000369 -0.024236 -0.107198 0.002248 0.002804 -0.083162 -0.000641
> > -0.006196 0.202806 -0.000316 0.053593 0.045544 -0.014533 0.047180 0.014289 0.000808 0.033574
> > -0.285388 -0.000072 -0.010398 0.028837 0.002979 0.001469 -0.089551 -0.000544 -0.036129 0.203395
> > 0.000029 -0.045510 0.029670 -0.008378 0.018735 0.064352 0.000545 0.012149 -0.210626 0.000215
> > 0.029217 -0.113644 0.000649 -0.003428 0.008629 -0.000285 0.017976 0.010439 -0.000203 0.016099
> > 0.004876 0.041591 -0.095893 -0.137995 -0.000931 -0.070297 0.348029 -0.000632 -0.047320 0.236001
> >
> > 40.1 2 -0.3599 -19.4764 -0.000106 0.000226 0.000580 -0.073008 -0.000234 -0.000347 -0.067727 -0.000227 -0.000507 -0.000143
> > 0.000306 0.000643 -0.233752 -0.000101 -0.001436 -0.166357 -0.000060 -0.000900 -0.000083 0.000072
> > -0.000094 -0.000155 -0.000191 -0.000217 0.000021 0.000176 -0.000259 -0.000249 0.000150 0.000079
> > -0.000171 -0.000115 0.000101 -0.000232 -0.000393 -0.225032 -0.000673 -0.000761 -0.161894 -0.000343
> > -0.000623 0.000058 -0.000151 0.000100 -0.025872 -0.000422 -0.000122 -0.046007 -0.000352 -0.000756
> > -0.000031 0.000029 0.000436 0.231937 0.001082 0.000555 0.174758 0.000689 0.000333 -0.000003
> > 0.000072 -0.000747 -0.013800 0.000182 -0.000197 0.010492 -0.000145 -0.000091 -0.000006 0.000008
> > 0.000088 -0.005108 -0.000410 0.000101 -0.013687 -0.000229 0.000327 0.000023 -0.000052 0.000029
> > -0.000438 0.000270 -0.000352 0.000087 0.000005 -0.000270 -0.000010 0.000038 -0.000194 0.007046
> > -0.000265 0.000293 0.004717 -0.000059 0.000075 -0.000001 0.000004 0.000044 0.019470 0.000312
> > -0.000082 0.013431 0.000176 0.000151 -0.000003 0.000016 -0.000184 0.009800 -0.000229 0.000035
> > 0.005666 -0.000184 -0.000138 -0.000009 0.000016 0.000247 0.003411 0.000252 0.000041 0.005594
> > 0.000294 -0.000144 -0.000013 0.000034 0.000012 0.434345 0.001340 0.000973 0.323035 0.000997
> > 0.000761 0.000020 -0.000049 -0.000036 0.024040 0.000257 0.000330 0.017128 0.000167 0.000234
> >
> > 41.1 2 -0.3536 -19.5439 -0.017565 0.033804 0.123813 0.000275 0.005909 -0.058985 0.000241 0.009161 -0.048064 -0.023379
> > 0.053376 0.073340 0.000543 0.172220 -0.130092 0.000349 0.130316 -0.087520 -0.024913 -0.024857
> > -0.036998 -0.039603 -0.097139 -0.083396 0.079166 0.079688 -0.142521 -0.117300 0.110128 0.081632
> > -0.098209 -0.087771 0.009996 -0.026423 -0.023336 0.000590 -0.014989 0.011646 0.000506 0.007388
> > -0.026195 0.006229 -0.012595 -0.017173 0.000742 -0.106861 -0.050713 0.000569 -0.015669 -0.094058
> > -0.006255 0.011589 0.071038 -0.000386 0.027600 -0.048762 -0.000043 -0.011185 -0.068327 -0.001083
> > 0.011384 -0.096429 -0.000215 0.117208 -0.032025 -0.000168 0.048001 0.008414 -0.001086 0.000745
> > 0.033803 0.000767 -0.249967 0.015663 0.000428 -0.161965 0.045611 0.005642 -0.015099 0.026461
> > -0.000306 0.210527 -0.097603 -0.000151 0.087806 -0.031788 0.002690 0.000788 -0.068893 0.000230
> > -0.166189 0.081811 0.000122 -0.086033 0.040175 -0.001303 0.003765 0.005612 -0.000466 0.153674
> > -0.001912 -0.000431 0.109815 0.029502 -0.005007 0.007683 0.020371 0.000544 -0.134667 -0.051868
> > 0.000408 -0.079642 -0.058028 -0.005763 0.014850 0.015994 -0.000735 0.162274 0.081523 -0.000286
> > 0.100712 -0.008981 -0.004002 0.010546 0.009565 -0.000138 -0.086419 -0.106685 -0.000145 -0.062551
> > -0.072268 0.002884 -0.007040 -0.005538 -0.000740 0.171454 0.065074 -0.000490 0.110922 0.044948
> >
> > 42.1 2 -0.3454 -19.9259 -0.032189 0.057250 0.256764 -0.000501 -0.018216 -0.109626 -0.000372 -0.022363 -0.105604 -0.058090
> > 0.128866 0.210115 0.001256 0.200788 -0.294008 0.000662 0.176997 -0.170333 -0.050762 -0.048372
> > -0.024677 -0.035114 0.007173 0.000806 -0.100676 -0.012900 0.057482 0.029690 -0.064014 -0.056596
> > 0.044989 0.053519 0.027944 -0.075243 -0.085297 -0.000157 0.022944 0.087192 0.000062 0.049593
> > 0.001985 0.040277 -0.082782 -0.133913 0.001286 -0.050652 -0.012519 0.001079 0.071286 -0.174182
> > -0.012856 0.023044 0.141957 -0.000112 0.048447 -0.058330 0.000698 -0.035805 -0.163482 0.001874
> > 0.009994 -0.160033 0.001050 -0.004732 -0.041968 0.000772 -0.088746 0.042772 -0.004118 0.006017
> > 0.064503 0.000205 0.121157 0.041943 -0.000070 0.065300 0.128564 0.009777 -0.018184 -0.030432
> > 0.000770 -0.142747 -0.062476 0.000742 -0.125118 -0.089107 -0.012161 0.024678 0.018213 -0.000562
> > 0.070395 0.031586 -0.000318 0.068608 -0.015288 0.003227 -0.006483 0.000369 -0.000474 -0.075874
> > -0.060403 -0.000420 -0.074424 0.005659 0.005587 -0.005923 -0.101819 -0.000591 0.044440 0.060464
> > -0.000241 0.014395 0.006090 0.002243 -0.008506 0.063527 0.000663 -0.090130 -0.079236 0.000323
> > -0.013733 -0.064571 -0.003629 0.010940 0.003378 0.001396 -0.166913 -0.275341 0.000940 -0.121964
> > -0.188452 0.004019 -0.010218 -0.005758 -0.000887 -0.140000 0.026031 -0.000679 -0.093990 0.020632
> >
> > 43.1 2 -0.3364 -19.7056 -0.000033 -0.000064 0.000996 0.233858 0.000762 -0.000100 0.214370 0.000638 -0.000180 -0.000273
> > 0.000604 0.001005 -0.088496 0.000601 -0.001828 -0.066876 0.000599 -0.001121 -0.000156 -0.000191
> > -0.000090 -0.000176 0.000110 0.000035 -0.000390 0.000012 0.000222 0.000117 -0.000195 -0.000179
> > 0.000160 0.000229 0.000095 -0.000279 -0.000436 0.054973 0.000193 0.000784 0.031455 0.000405
> > 0.000155 0.000218 -0.000462 -0.000608 -0.198893 -0.000888 -0.000777 -0.137268 -0.000101 -0.001284
> > -0.000077 0.000158 0.000447 -0.013372 0.000203 -0.000160 -0.019675 -0.000303 -0.000805 0.000004
> > 0.000059 -0.000737 -0.212485 -0.000829 -0.000630 -0.148266 -0.001018 -0.000186 -0.000018 0.000031
> > 0.000248 -0.198481 -0.000127 -0.000521 -0.140351 -0.000111 0.000157 0.000042 -0.000078 -0.000139
> > -0.062913 -0.000800 -0.000414 -0.040839 -0.000674 -0.000508 -0.000048 0.000097 0.000060 0.038593
> > 0.000356 0.000200 0.022252 0.000318 -0.000022 0.000017 -0.000037 0.000012 0.193520 0.000316
> > 0.000423 0.137724 0.000114 0.000476 0.000023 -0.000026 -0.000424 0.038120 0.000232 0.000301
> > 0.023942 0.000071 0.000070 0.000016 -0.000053 0.000299 -0.068911 -0.000530 -0.000472 -0.047524
> > -0.000117 -0.000370 -0.000012 0.000036 0.000019 -0.030041 -0.000741 -0.001238 -0.020334 -0.000521
> > -0.000844 0.000012 -0.000031 -0.000005 0.282006 0.000291 0.000973 0.209020 0.000250 0.000729
> >
> > 44.1 2 -0.2872 -19.6668 -0.000144 0.000421 0.000188 -0.328706 -0.001318 -0.000558 -0.324542 -0.001247 -0.000455 0.000079
> > -0.000177 -0.000291 0.244901 0.000467 0.001404 0.193484 0.000333 0.001052 -0.000167 -0.000114
> > 0.000033 0.000096 0.000003 0.000068 0.000046 -0.000083 -0.000006 0.000023 -0.000005 0.000012
> > -0.000000 -0.000023 0.000001 0.000010 0.000203 0.036373 0.000259 -0.000179 0.045010 0.000021
> > 0.000177 -0.000053 0.000138 -0.000192 0.190821 0.000831 0.000574 0.150130 0.000545 0.000646
> > 0.000062 -0.000163 0.000076 0.016506 -0.000081 0.000122 0.029985 0.000185 0.000208 -0.000007
> > -0.000011 0.000320 0.013189 0.000055 0.000033 0.005358 0.000217 0.000102 -0.000007 0.000021
> > 0.000029 -0.160409 -0.000495 -0.000435 -0.125767 -0.000515 -0.000497 -0.000012 0.000020 0.000100
> > -0.110486 -0.000258 -0.000274 -0.070642 -0.000131 -0.000092 0.000008 -0.000018 0.000013 -0.042538
> > -0.000118 -0.000145 -0.045794 -0.000166 -0.000103 -0.000006 0.000017 -0.000021 0.100737 0.000288
> > 0.000354 0.088528 0.000309 0.000245 -0.000008 0.000007 0.000165 -0.066160 -0.000168 -0.000212
> > -0.059460 -0.000106 -0.000130 0.000004 0.000001 -0.000191 -0.139333 -0.000432 -0.000411 -0.105197
> > -0.000422 -0.000275 0.000004 -0.000004 -0.000044 0.102617 0.000331 0.000111 0.079847 0.000225
> > 0.000074 -0.000001 0.000005 -0.000018 0.235870 0.000777 0.000754 0.186016 0.000606 0.000590
> >
> > 45.1 2 -0.2754 -19.8709 0.015328 -0.015886 -0.200373 -0.001144 0.204249 0.018420 -0.001540 0.257638 0.069571 -0.034369
> > 0.079346 0.103034 0.000136 0.220373 -0.184672 0.000226 0.171836 -0.178294 0.005025 0.018171
> > -0.067837 -0.058901 -0.010376 -0.058611 -0.023147 0.019317 0.001082 -0.006691 -0.010943 -0.015293
> > 0.000024 0.010459 0.012597 -0.035819 0.008538 -0.000133 -0.054924 0.080119 0.000403 -0.048488
> > -0.057518 -0.008812 -0.004965 0.294048 0.000198 -0.142875 0.172977 0.000583 -0.153372 0.042201
> > -0.022097 0.051589 0.160786 0.000475 0.021600 -0.153837 -0.000842 0.088789 0.127674 0.005387
> > -0.006814 -0.133544 0.000326 -0.030944 -0.064554 0.000626 -0.090371 -0.111972 -0.007173 0.015706
> > -0.018503 -0.000304 0.012897 0.049120 -0.000463 0.061317 0.061213 0.005758 -0.009666 -0.051474
> > 0.000070 -0.029147 -0.027380 0.000124 -0.029118 -0.033224 -0.006866 0.013405 0.029239 -0.000057
> > -0.007231 0.008871 -0.000036 -0.000866 -0.004329 0.001232 -0.002863 0.007997 0.000101 0.002830
> > -0.010454 0.000136 -0.026910 0.004005 0.001646 0.000883 -0.054942 -0.000134 -0.011110 0.029816
> > 0.000015 -0.027705 0.000208 0.003335 -0.010002 0.052048 0.000051 -0.022676 -0.037318 -0.000114
> > 0.025099 -0.023139 0.000391 0.000308 -0.013637 -0.002230 0.150326 0.447374 -0.001664 0.108558
> > 0.341850 0.000272 -0.000827 0.001882 0.000382 -0.062926 0.001897 0.000291 -0.045574 0.001927
> >
> > 46.1 2 -0.2391 -18.4383 -0.000253 0.001555 -0.002838 -0.000041 0.016265 -0.003568 -0.000079 0.021692 0.002519 -0.007120
> > 0.016299 0.024610 0.000036 0.026232 -0.032911 0.000028 0.021010 -0.026315 -0.002494 -0.002353
> > -0.006082 -0.008102 0.002630 0.010059 -0.059366 -0.025613 0.042974 0.063967 -0.042187 -0.066715
> > 0.054278 0.050419 0.003022 -0.008126 -0.005208 -0.000032 -0.001458 0.013770 0.000016 0.003191
> > -0.003676 0.001348 -0.003418 -0.008413 -0.000022 -0.010204 0.014361 -0.000029 0.001664 0.004902
> > -0.002662 0.005434 0.025157 0.000037 0.003386 -0.013849 -0.000031 0.006002 0.000567 0.001173
> > -0.002340 -0.012845 0.000004 -0.001334 -0.007603 -0.000078 0.011276 0.007738 -0.001116 0.002810
> > -0.003210 -0.000235 0.059847 0.013360 -0.000086 0.007368 0.017427 -0.011332 0.016967 0.100628
> > 0.000390 -0.053652 -0.069700 0.000588 -0.098084 -0.092344 0.032941 -0.053734 -0.305662 -0.000880
> > 0.151624 0.146522 -0.000729 0.174791 0.072713 0.000815 -0.001723 -0.001142 0.000634 -0.181053
> > -0.033032 -0.000374 0.105452 0.017553 -0.034432 0.057006 0.308834 -0.000309 0.188344 -0.085589
> > -0.000512 0.182009 -0.012372 0.014218 -0.023546 -0.111479 0.000063 -0.063517 0.039146 0.000107
> > -0.091636 0.053091 0.000116 0.000111 -0.002585 -0.000111 0.006574 0.024682 -0.000087 0.004508
> > 0.020778 -0.000065 0.000274 0.000114 -0.001902 0.541900 0.091988 -0.001490 0.424540 0.071979
> >
> > 47.1 2 -0.2189 -18.9078 0.000011 -0.000035 -0.000019 0.026633 0.000088 0.000051 0.030292 0.000085 0.000053 -0.000001
> > 0.000001 0.000005 -0.030843 -0.000108 -0.000116 -0.025050 -0.000087 -0.000087 0.000022 0.000016
> > 0.000009 0.000007 0.000008 -0.000006 0.000003 -0.000003 -0.000004 -0.000005 -0.000005 0.000000
> > 0.000006 0.000011 -0.000001 0.000003 -0.000023 -0.020445 -0.000072 -0.000064 -0.020683 -0.000059
> > -0.000072 0.000004 -0.000003 -0.000048 0.003872 0.000019 0.000012 0.011400 0.000060 0.000011
> > -0.000003 0.000007 -0.000001 0.003930 0.000028 0.000021 -0.002749 -0.000006 -0.000044 -0.000000
> > -0.000003 0.000017 0.017388 0.000049 0.000051 0.007434 0.000008 0.000037 0.000006 -0.000016
> > 0.000012 0.018847 0.000048 0.000055 0.021716 0.000074 0.000053 -0.000008 0.000021 -0.000012
> > 0.268919 0.000813 0.000825 0.221286 0.000693 0.000703 0.000010 -0.000031 0.000047 0.274187
> > 0.000788 0.000846 0.234439 0.000637 0.000718 -0.000004 0.000011 -0.000006 0.000317 0.000010
> > 0.000012 0.001156 -0.000054 -0.000019 -0.000001 0.000007 -0.000017 -0.280313 -0.000832 -0.000861
> > -0.239045 -0.000729 -0.000710 -0.000002 0.000004 -0.000009 -0.267205 -0.000823 -0.000797 -0.229901
> > -0.000704 -0.000680 -0.000000 -0.000002 0.000016 -0.019363 -0.000084 -0.000076 -0.015971 -0.000062
> > -0.000062 -0.000000 0.000001 -0.000005 0.005323 -0.000027 0.000008 0.004429 -0.000013 0.000008
> >
> > 48.1 2 -0.2068 -19.3465 0.000065 -0.000199 -0.000021 0.168287 0.000535 0.000309 0.192938 0.000502 0.000382 0.000008
> > -0.000013 -0.000097 -0.214167 -0.000713 -0.000765 -0.199433 -0.000674 -0.000732 0.000145 0.000027
> > 0.000066 0.000071 -0.000015 0.000051 -0.000015 -0.000049 -0.000001 0.000022 -0.000001 0.000013
> > 0.000005 -0.000038 -0.000000 0.000022 -0.000111 -0.189905 -0.000654 -0.000663 -0.177621 -0.000569
> > -0.000685 -0.000003 0.000032 -0.000172 0.185001 0.000626 0.000526 0.176695 0.000742 0.000694
> > -0.000017 0.000067 -0.000207 0.050589 0.000291 0.000240 0.015447 -0.000061 -0.000066 -0.000001
> > -0.000014 0.000300 0.219991 0.000790 0.000577 0.178365 0.000806 0.000505 0.000001 -0.000000
> > -0.000007 0.055112 0.000155 0.000175 0.048285 0.000075 -0.000016 0.000013 -0.000026 -0.000073
> > -0.113290 -0.000325 -0.000380 -0.098995 -0.000256 -0.000237 -0.000008 0.000017 0.000081 -0.149961
> > -0.000429 -0.000437 -0.146393 -0.000458 -0.000404 0.000002 0.000001 -0.000049 0.010091 0.000013
> > 0.000023 0.034903 0.000127 0.000068 -0.000003 -0.000000 0.000103 -0.110770 -0.000316 -0.000354
> > -0.114844 -0.000283 -0.000325 -0.000002 0.000012 -0.000116 -0.074511 -0.000227 -0.000206 -0.062511
> > -0.000293 -0.000160 -0.000001 0.000001 0.000013 -0.225924 -0.000980 -0.000850 -0.201534 -0.000850
> > -0.000744 -0.000000 0.000002 -0.000017 0.214633 0.000663 0.000708 0.185378 0.000570 0.000607
> >
> > 49.1 2 -0.1076 -19.2741 -0.000004 0.000012 0.000034 0.023260 0.000051 0.000010 0.041560 0.000066 0.000284 0.000012
> > -0.000011 -0.000235 -0.049614 -0.000162 -0.000137 -0.064193 -0.000216 -0.000263 0.000003 -0.000184
> > 0.000048 0.000132 0.000016 0.000092 -0.000004 0.000013 -0.000003 -0.000049 -0.000000 -0.000007
> > -0.000010 0.000020 0.000014 -0.000013 0.000021 -0.167683 -0.000543 -0.000641 -0.168008 -0.000686
> > -0.000724 -0.000013 0.000061 -0.000318 0.251414 0.000863 0.000783 0.287004 0.001202 0.001111
> > 0.000005 -0.000010 0.000053 0.104676 0.000451 0.000439 0.071228 0.000253 0.000232 -0.000000
> > -0.000023 0.000283 -0.035461 -0.000135 -0.000090 -0.055030 0.000032 0.000118 -0.000012 0.000039
> > -0.000032 -0.274407 -0.000832 -0.000767 -0.291322 -0.001121 -0.000722 -0.000002 -0.000017 0.000262
> > -0.011952 -0.000026 -0.000048 0.005548 -0.000137 0.000006 0.000004 -0.000001 -0.000086 0.184366
> > 0.000527 0.000584 0.206076 0.000691 0.000635 -0.000004 0.000006 0.000068 0.079981 0.000238
> > 0.000270 0.028103 0.000094 0.000135 0.000000 -0.000001 -0.000012 0.192969 0.000568 0.000607
> > 0.221574 0.000638 0.000690 0.000005 -0.000016 -0.000066 -0.013907 -0.000053 -0.000065 -0.007947
> > 0.000004 -0.000051 0.000003 -0.000001 -0.000049 -0.172993 -0.000751 -0.000619 -0.172671 -0.000760
> > -0.000614 0.000000 -0.000003 0.000009 -0.238358 -0.000697 -0.000779 -0.225527 -0.000664 -0.000735
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 5 1.24 500 600 700 1000 2101
> > VAR BASINP GEOM BASIS RHF
> >
> > PROGRAMS * HF-SCF MATROP INT
> > CPU TIMES * 16.80 2.29 80.67
> > REAL TIME * 2 MIN,25.49 SEC CPU TIME * 1 MIN,43.07 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
> >
> >
> > PROGRAM * MATROP
> >
> >
> > Orbitals ORBITALS read from record 2101.2 Type=RHF/CANONICAL (state 1.1)
> >
> > Matrix ORBITALS written to file adfthforbtest.orb
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 5 1.24 500 600 700 1000 2101
> > VAR BASINP GEOM BASIS RHF
> >
> > PROGRAMS * MATROP HF-SCF MATROP INT
> > CPU TIMES * 0.13 16.80 2.29 80.67
> > REAL TIME * 2 MIN,25.64 SEC CPU TIME * 1 MIN,43.20 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
> >
> > HF-SCF
> > -641.12706630
> > **********************************************************************************************************************************
> > Variable memory released
>
> >
> > Primary working directories: /u/s/seth/molpro
> > Secondary working directories: /u/s/seth/molpro
> >
> > blaslib=hpblas_pa20_64
> > mxmblk=120 mxmbln=120 ncache= 43200 mindgm= 33 mindgv= 32 mindgc= 33 mindgl= 33 mindgr= 33 noblas=0 nroll=4 minvec=7
> > default implementation of scratch files=df
> >
> > ***,single point energy of GFP anion w/ 6-31G / s1 / EOM-CCSD
> > !using the optimized geometry from CAS(2/2) calculation
> > gprint,orbitals,civector; !print the orbitals
> > memory,50,m
> > FILE,1,adftc22s2orbtest.int,new
> > FILE,2,adftc22s2orbtest.wfn
> > PUNCH,adftc22s2orbtest.pun,new
> > geometry={nosymm,noorient;angstrom;
> > N3I;
> > H1N3I, 1, RNH1;
> > C4I, 1, RCN2, 2, ACNH1;
> > H1C4I, 3, RCH3, 1, AHCN2, 2, DHCNH1;
> > N5I, 3, RCN4, 1, ANCN3, 2, DNCNH2;
> > C1I, 5, RCN5, 3, ACNC4, 1, DCNCN3;
> > C2I, 6, RCC6, 5, ACCN5, 3, DCCNC4;
> > O1C2I, 7, RCO7, 1, AOCN6, 3, DOCNC5;
> > C1B, 6, RCC8, 7, ACCC7, 8, DCCCO6;
> > H1C1B, 9, RCH9, 6, AHCC8, 7, DHCCC7;
> > C1P, 9, RCC10, 6, ACCC9, 5, DCCCN8;
> > C2P, 11, RCC11, 9, ACCC10, 6, DCCCC9;
> > H1C2P, 12, RCH12, 11, AHCC11, 9, DHCCC10;
> > C3P, 12, RCC13, 11, ACCC12, 9, DCCCC11;
> > H1C3P, 14, RCH14, 12, AHCC13, 11, DHCCC12;
> > C4P, 14, RCC15, 12, ACCC14, 11, DCCCC13;
> > C5P, 16, RCC16, 14, ACCC15, 12, DCCCC14;
> > H1C5P, 17, RCH17, 16, AHCC16, 14, DHCCC15;
> > C6P, 17, RCC18, 16, ACCC17, 14, DCCCC16;
> > H1C6P, 19, RCH19, 11, AHCC18, 12, DHCCC17;
> > O1C4P, 16, RCO20, 17, AOCC19, 19, DOCCC18;
> > }
> > RNH1 = 1.005747399,
> > RCN2 = 1.3945882092,
> > ACNH1 = 128.0013571362,
> > RCH3 = 1.0797225562,
> > AHCN2 = 122.3460687393,
> > DHCNH1 = .3176017435,
> > RCN4 = 1.3134755048,
> > ANCN3 = 112.53691522,
> > DNCNH2 = -179.7392991266,
> > RCN5 = 1.4236637916,
> > ACNC4 = 106.3851163995,
> > DCNCN3 = .0425985123,
> > RCC6 = 1.4580637676,
> > ACCN5 = 109.5997506423,
> > DCCNC4 = -.0046725228,
> > RCO7 = 1.2635478249,
> > AOCN6 = 124.377425139,
> > DOCNC5 = -179.936707378,
> > RCC8 = 1.3919476044
> > ACCC7 = 123.0132405084,
> > DCCCO6 = -.0826599548,
> > RCH9 = 1.0916391744,
> > AHCC8 = 112.7288126832,
> > DHCCC7 = .0516503223,
> > RCC10 = 1.4081218616,
> > ACCC9 = 131.681001285,
> > DCCCN8 = -.006777037,
> > RCC11 = 1.440218179,
> > ACCC10 = 123.9863979838,
> > DCCCC9 = -.037849871,
> > RCH12 = 1.0848026812,
> > AHCC11 = 117.3600052667,
> > DHCCC10 = .0354370882,
> > RCC13 = 1.3706965261,
> > ACCC12 = 121.4414468782,
> > DCCCC11 = -179.9748659666,
> > RCH14 = 1.0868211545,
> > AHCC13 = 121.0604969298,
> > DHCCC12 = 179.9868388872,
> > RCC15 = 1.4585766318,
> > ACCC14 = 122.5576042229,
> > DCCCC13 = .0085101095,
> > RCC16 = 1.4576830269,
> > ACCC15 = 115.2202315751,
> > DCCCC14 = -.0130136984,
> > RCH17 = 1.0865772129,
> > AHCC16 = 116.6765489817,
> > DHCCC15 = -179.9975417066,
> > RCC18 = 1.3710085894,
> > ACCC17 = 121.7561012207,
> > DCCCC16 = .0139088911,
> > RCH19 = 1.0900476701,
> > AHCC18 = 117.8142224997,
> > DHCCC17 = -179.9911160458,
> > RCO20 = 1.2805054795,
> > AOCC19 = 122.3700215446,
> > DOCCC18 = -179.985549464;
> >
> >
> >
> > basis=6-31G;
> >
> > matrop
> > read,orbitals,orbitals
> > Including file /usr1/seth/tests/molpro/adfthforbtest.orb
> > save,orbitals,2101.2,orbitals
> >
> >
> > multi
> > start,2101.2
> > occ,50
> > closed,48
> > wf,98,1,0
> > state,1
> > natorb,2141.2
> >
> >
> > matrop
> > load,orbitals,orb,2141.2
> > write,orbitals,adftc22s2orbtest.orb,new
> > ---
> >1
> >
> >
> > *** PROGRAM SYSTEM MOLPRO ***
> > Copyright, University of Birmingham, 1997
> >
> > Version 2002.4 linked 22, Aug AM 2002
> >
> >
> > **********************************************************************************************************************************
> > LABEL * SINGLE POINT ENERGY OF GFP ANION W/ 6-31G / S1 / EOM-CCSD
> > HP-UX-B.11.11/mesa113(9000/785) 64 bit version DATE: 20-Oct-02 TIME: 23:23:29
> > **********************************************************************************************************************************
> >
> > Installed patches: blas5 cc_ifc chgfracfix cilssym drv2el_llmp2 ecp_parse
> > fitmos fitmos6 ga_avqz ibm64_gmainv linux_gmalloc linux_ia64
> > linuxconf linuxconf2 linuxtune molproc_cray molproc_ibm myrinetports
> > opt_linear_triatomic p3_mkl parse_ibm rccsd rilmp2g_5 rs2grad
> > t1diag_uccsd2 test_cfit
> > **********************************************************************************************************************************
> >
> >
> > Variable memory set to 50000000 words, buffer space 230000 words
> >
> >
> > Permanent file 1 adftc22s2orbtest.int assigned. Implementation=df
> > Permanent file 2 adftc22s2orbtest.wfn assigned. Implementation=df
> >
> >
> > PUNCHFILE ADFTC22S2ORBTEST.PUN OPENED
> > SETTING RNH1 = 1.00574740
> > SETTING RCN2 = 1.39458821
> > SETTING ACNH1 = 128.00135714
> > SETTING RCH3 = 1.07972256
> > SETTING AHCN2 = 122.34606874
> > SETTING DHCNH1 = 0.31760174
> > SETTING RCN4 = 1.31347550
> > SETTING ANCN3 = 112.53691522
> > SETTING DNCNH2 = -179.73929913
> > SETTING RCN5 = 1.42366379
> > SETTING ACNC4 = 106.38511640
> > SETTING DCNCN3 = 0.04259851
> > SETTING RCC6 = 1.45806377
> > SETTING ACCN5 = 109.59975064
> > SETTING DCCNC4 = -0.00467252
> > SETTING RCO7 = 1.26354782
> > SETTING AOCN6 = 124.37742514
> > SETTING DOCNC5 = -179.93670738
> > SETTING RCC8 = 1.39194760
> > SETTING ACCC7 = 123.01324051
> > SETTING DCCCO6 = -0.08265995
> > SETTING RCH9 = 1.09163917
> > SETTING AHCC8 = 112.72881268
> > SETTING DHCCC7 = 0.05165032
> > SETTING RCC10 = 1.40812186
> > SETTING ACCC9 = 131.68100129
> > SETTING DCCCN8 = -0.00677704
> > SETTING RCC11 = 1.44021818
> > SETTING ACCC10 = 123.98639798
> > SETTING DCCCC9 = -0.03784987
> > SETTING RCH12 = 1.08480268
> > SETTING AHCC11 = 117.36000527
> > SETTING DHCCC10 = 0.03543709
> > SETTING RCC13 = 1.37069653
> > SETTING ACCC12 = 121.44144688
> > SETTING DCCCC11 = -179.97486597
> > SETTING RCH14 = 1.08682115
> > SETTING AHCC13 = 121.06049693
> > SETTING DHCCC12 = 179.98683889
> > SETTING RCC15 = 1.45857663
> > SETTING ACCC14 = 122.55760422
> > SETTING DCCCC13 = 0.00851011
> > SETTING RCC16 = 1.45768303
> > SETTING ACCC15 = 115.22023158
> > SETTING DCCCC14 = -0.01301370
> > SETTING RCH17 = 1.08657721
> > SETTING AHCC16 = 116.67654898
> > SETTING DHCCC15 = -179.99754171
> > SETTING RCC18 = 1.37100859
> > SETTING ACCC17 = 121.75610122
> > SETTING DCCCC16 = 0.01390889
> > SETTING RCH19 = 1.09004767
> > SETTING AHCC18 = 117.81422250
> > SETTING DHCCC17 = -179.99111605
> > SETTING RCO20 = 1.28050548
> > SETTING AOCC19 = 122.37002154
> > SETTING DOCCC18 = -179.98554946
> > SETTING BASIS = 6-31G
> >
> >
> > Using spherical harmonics
> >
> > Library entry N S 6-31G selected for orbital group 1
> > Library entry N P 6-31G selected for orbital group 1
> > Library entry H S 6-31G selected for orbital group 2
> > Library entry C S 6-31G selected for orbital group 3
> > Library entry C P 6-31G selected for orbital group 3
> > Library entry O S 6-31G selected for orbital group 4
> > Library entry O P 6-31G selected for orbital group 4
> >
> >1PROGRAM * SEWARD (Integral evaluation for generally contracted gaussian basis sets) Author: Roland Lindh, 1990
> >
> > Geometry written to block 1 of record 700
> >
> >
> > Point group C1
> >
> >
> >
> > ATOMIC COORDINATES
> >
> > NR ATOM CHARGE X Y Z
> >
> > 1 N3I 7.00 0.000000000 0.000000000 0.000000000
> > 2 N5I 7.00 0.010431302 1.414861300 -4.014785148
> > 3 H1N3 1.00 0.000000000 0.000000000 1.900586998
> > 4 H1C4 1.00 -0.009555190 3.998186714 -0.936365833
> > 5 H1C1 1.00 0.037048262 -4.842349200 -5.683459422
> > 6 H1C2 1.00 0.023252431 1.787785411 -8.471505200
> > 7 H1C3 1.00 0.035800670 2.555611264 -13.120290772
> > 8 H1C5 1.00 0.063544986 -5.505293123 -14.457131297
> > 9 H1C6 1.00 0.051902618 -6.262376978 -9.825928069
> > 10 C4I 6.00 0.000000000 2.076676899 -1.622557028
> > 11 C1I 6.00 0.020040963 -1.275109007 -4.057993260
> > 12 C2I 6.00 0.014486441 -2.240975847 -1.477494395
> > 13 C1B 6.00 0.031245874 -2.838473524 -6.173357932
> > 14 C1P 6.00 0.036553864 -2.291919683 -8.777581938
> > 15 C2P 6.00 0.032216259 0.229126050 -9.803014834
> > 16 C3P 6.00 0.038723243 0.648069323 -12.359143125
> > 17 C4P 6.00 0.050702396 -1.404582167 -14.198633299
> > 18 C5P 6.00 0.054725214 -3.941821889 -13.126095184
> > 19 C6P 6.00 0.048183491 -4.340049751 -10.566061048
> > 20 O1C2 8.00 0.020360044 -4.451321754 -0.574316511
> > 21 O1C4 8.00 0.057242341 -1.007042678 -16.585550415
> >
> > Bond lengths in Bohr (Angstrom)
> >
> > 1--3 1.900586998 1-10 2.635389582 1-12 2.684245200 2-10 2.482108797 2-11 2.690334466
> > (1.005747399) (1.394588209) (1.420441491) (1.313475505) (1.423663792)
> >
> > 4-10 2.040379775 5-13 2.062898918 6-15 2.049979819 7-16 2.053794181 8-18 2.053333198
> > (1.079722556) (1.091639174) (1.084802681) (1.086821155) (1.086577213)
> >
> > 9-19 2.059891411 11-12 2.755340995 11-13 2.630399563 12-20 2.387759163 13-14 2.660964477
> > (1.090047670) (1.458063768) (1.391947604) (1.263547825) (1.408121862)
> >
> > 14-15 2.721617722 14-19 2.719122937 15-16 2.590240848 16-17 2.756310167 17-18 2.754621499
> > (1.440218179) (1.438897996) (1.370696526) (1.458576632) (1.457683027)
> >
> > 17-21 2.419804483 18-19 2.590830562
> > (1.280505480) (1.371008589)
> >
> > Bond angles
> >
> > 1-10--2 112.53691522 1-10--4 122.34606874 1-12-11 102.87702134 1-12-20 124.37742514
> >
> > 2-10--4 125.11698909 2-11-12 109.59975064 2-11-13 127.38699328 3--1-10 128.00135714
> >
> > 3--1-12 123.39665352 5-13-11 112.72881268 5-13-14 115.59018558 6-15-14 117.36000527
> >
> > 6-15-16 121.19854703 7-16-15 121.06049693 7-16-17 116.38189554 8-18-17 116.67654898
> >
> > 8-18-19 121.56734878 9-19-14 117.81422250 9-19-18 119.89902767 10--1-12 108.60115839
> >
> > 10--2-11 106.38511640 11-12-20 132.74555306 11-13-14 131.68100129 12-11-13 123.01324051
> >
> > 13-14-15 123.98639798 13-14-19 119.27573100 14-15-16 121.44144688 14-19-18 122.28674971
> >
> > 15-14-19 116.73786479 15-16-17 122.55760422 16-17-18 115.22023158 16-17-21 122.40974688
> >
> > 17-18-19 121.75610122 18-17-21 122.37002154
> >
> > NUCLEAR CHARGE: 97
> > NUMBER OF PRIMITIVE AOS: 336
> > NUMBER OF SYMMETRY AOS: 336
> > NUMBER OF CONTRACTIONS: 140 ( 140A )
> > NUMBER OF CORE ORBITALS: 14 ( 14A )
> > NUMBER OF VALENCE ORBITALS: 63 ( 63A )
> >
> >
> > NUCLEAR REPULSION ENERGY 769.57885442
> >
> >
> > Eigenvalues of metric
> >
> > 1 0.656E-03 0.147E-02 0.198E-02 0.287E-02 0.359E-02 0.477E-02 0.553E-02 0.589E-02
> >
> >
> > Contracted 2-electron integrals neglected if value below 1.0D-11
> > AO integral compression algorithm 1 Integral accuracy 1.0D-11
> >
> > 101.450 MB (compressed) written to integral file ( 25.8%)
> >
> >
> > NUMBER OF SORTED TWO-ELECTRON INTEGRALS: 48713385. BUFFER LENGTH: 32768
> > NUMBER OF SEGMENTS: 4 SEGMENT LENGTH: 15834483 RECORD LENGTH: 65536
> >
> > Memory used in sort: 15.93 MW
> >
> > SORT1 READ 49003036. AND WROTE 24844521. INTEGRALS IN 571 RECORDS. CPU TIME: 7.39 SEC, REAL TIME: 21.96 SEC
> > SORT2 READ 24844521. AND WROTE 48713385. INTEGRALS IN 387 RECORDS. CPU TIME: 12.11 SEC, REAL TIME: 35.14 SEC
> >
> > FILE SIZES: FILE 1: 105.3 MBYTE, FILE 4: 299.4 MBYTE, TOTAL: 404.7 MBYTE
> >
> > OPERATOR DM FOR CENTER 0 COORDINATES: 0.000000 0.000000 0.000000
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 4 0.83 500 600 700 1000
> > VAR BASINP GEOM BASIS
> >
> > PROGRAMS * INT
> > CPU TIMES * 80.76
> > REAL TIME * 2 MIN, 4.61 SEC CPU TIME * 1 MIN,24.05 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
> >
> > PROGRAM * MATROP
> >
> >
> > READING MATRIX ORBITALS (ORBITALS) FROM INPUT. SYMMETRY=1
> >
> > Orbitals ORBITALS saved in record 2101.2 (set 1)
> >
> > = *
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 5 1.00 500 600 700 1000 2101
> > VAR BASINP GEOM BASIS MATROP
> >
> > PROGRAMS * MATROP INT
> > CPU TIMES * 2.29 80.76
> > REAL TIME * 2 MIN, 6.95 SEC CPU TIME * 1 MIN,26.35 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
> >
> >
> > ILLEGAL COMMAND OCC
> >
> >
> > ILLEGAL COMMAND CLOSED
> >
> >
> > ILLEGAL COMMAND WF
> >
> >
> > ILLEGAL COMMAND NATORB
> >
> >
> > PROGRAM * MATROP
> >
> >
> >
> > ?DUMP RECORD 2141.2 NOT FOUND
> >
> > ERROR EXIT
> >
> >
> > **********************************************************************************************************************************
> > DATASETS * FILE NREC LENGTH (MB) RECORD NAMES
> > 1 18 86.08 500 600 700 960 900 950 1000 1100 1400 1410
> > VAR BASINP GEOM ABASIS SYMINP ZMAT BASIS S T V
> > 1200 1210 1080 1600 129 1650 1300 1700
> > H0 H01 AOSYM SMH P2S MOLCAS ERIS OPER
> >
> > 2 5 1.00 500 600 700 1000 2101
> > VAR BASINP GEOM BASIS MATROP
> >
> > PROGRAMS * MATROP MATROP INT
> > CPU TIMES * 0.01 2.29 80.76
> > REAL TIME * 2 MIN, 6.99 SEC CPU TIME * 1 MIN,26.37 SEC I/O TIME * 0 MIN, 0.69 SEC
> > DISK USED * 406.06 MB
> > **********************************************************************************************************************************
>
> ># MATRIX ORBITALS ORBITALS CANONICAL SYMMETRY=1
> > -0.00002792, -0.00000253, 0.99607779, 0.00039560, -0.00015026,
> > -0.00014618, -0.00000247, -0.00000687, 0.00000132, -0.00003004,
> > -0.00000161, 0.00000380, 0.00000185, -0.00000058, -0.10241231,
> > -0.08188081, 0.00055944, -0.14417419, -0.02739370, -0.01073281,
> > 0.00172448, 0.01059316, -0.00751153, -0.04474632, -0.00752244,
> > -0.00952802, 0.00569838, -0.01754798, 0.01059275, 0.01164654,
> > 0.00281322, -0.00045041, -0.00729156, 0.00059928, 0.00058773,
> > 0.00755899, 0.00300289, -0.00004088, 0.01021147, -0.00010645,
> > -0.01756527, -0.03218902, -0.00003255, -0.00014397, 0.01532754,
> > -0.00025305, 0.00001147, 0.00006502, -0.00000389, 0.00004335,
> > -0.00007274, 0.00036366, 0.07845877, 0.00119564, -0.02055508,
> > 0.04322043, 0.00751450, -0.00000831, 0.00563049, -0.00534303,
> > -0.03525867, -0.00942090, -0.00001105, -0.06100236, 0.01640327,
> > -0.02259570, -0.05445359, 0.00206109, 0.06072981, -0.00291279,
> > -0.00701051, 0.01281232, 0.05003013, -0.01177264, -0.03736938,
> > -0.00003452, 0.00993280, -0.00651228, -0.00000103, -0.00742738,
> > 0.00001012, 0.00946498, -0.04678061, 0.00412055, 0.00003797,
> > -0.00000418, 0.00861857, -0.00554227, -0.00151536, 0.00990943,
> > -0.00002707, -0.00003854, 0.00890230, -0.00761090, 0.00006417,
> > 0.00040532, -0.00904540, 0.00012667, 0.00014691, -0.00015391,
> > 0.01690222, -0.00912807, 0.00259350, -0.00735772, 0.00004451,
> > 0.00618252, -0.00368635, 0.01098807, 0.00268259, 0.03644217,
> > 0.00258496, 0.00050487, -0.00177857, -0.00013703, -0.00347328,
> > 0.00787334, 0.00927714, -0.00347468, -0.00498363, 0.00001220,
> > -0.00604052, -0.00587136, 0.00427916, 0.00788744, -0.00434737,
> > -0.00352791, 0.00490204, 0.00035807, -0.00425008, 0.00590885,
> > -0.00969370, 0.01336158, 0.00881111, 0.01113095, 0.03827166,
> > 0.00708546, -0.01404595, -0.00658761, 0.00215713, 0.02308104,
> > -0.00041187, -0.00002636, 0.02482267, 0.00008690, -0.00003723,
> > 0.00025113, -0.00002640, -0.00005215, 0.00001841, -0.00032368,
> > -0.00001930, 0.00003760, 0.00002383, -0.00000521, 0.20452137,
> > 0.16257576, -0.00085250, 0.29616086, 0.05592352, 0.02078839,
> > -0.00340974, -0.02577129, 0.01886019, 0.09852957, 0.01648494,
> > 0.02137524, -0.00844626, 0.03160701, -0.02260585, -0.02545493,
> > -0.00386866, 0.00086769, 0.01660886, 0.00170125, -0.00397449,
> > -0.01923747, -0.00536425, 0.00010853, -0.02023322, 0.00022553,
> > 0.03380353, 0.05725021, -0.00006359, 0.00042138, -0.01588595,
> > 0.00155471, -0.00003454, -0.00019927, 0.00001240, -0.00011741,
> > 0.00013326, -0.00062041, -0.11605525, -0.00165451, 0.04645458,
> > -0.08961485, -0.01535644, -0.00005418, -0.00182649, 0.00088933,
> > 0.03807766, 0.02793387, 0.00002921, 0.06395438, -0.01072583,
> > 0.01790405, 0.10045298, 0.01843442, -0.06092596, 0.02755640,
> > 0.04250160, -0.02636852, -0.10944261, -0.02946640, 0.07214250,
> > 0.00014610, -0.01677693, 0.01074960, 0.00010867, 0.03461548,
> > -0.00003563, -0.04773759, 0.08595402, 0.01466690, 0.00009422,
> > 0.00008351, -0.01833949, -0.03127504, 0.00395510, 0.05765070,
> > -0.00024791, 0.00008122, -0.08007036, 0.03520293, -0.00015231,
> > 0.00506320, 0.00242046, -0.00026608, -0.00068537, 0.00078946,
> > -0.14542413, 0.14892442, -0.03720786, 0.02456634, -0.00047285,
> > -0.06913238, 0.05775995, -0.12106073, -0.07177527, -0.30702925,
> > 0.00654965, -0.03642353, 0.03458475, 0.04222506, 0.08458381,
> > -0.13960730, -0.19337813, 0.07081159, 0.03958799, -0.00048174,
> > 0.23635694, 0.30794944, -0.16409319, -0.00047572, -0.12438755,
> > -0.20260060, 0.09631312, -0.48252266, -0.19760085, 0.24835236,
> > -0.66850884, 0.50794428, 0.10869656, 0.19957659, 1.58208158,
> > 0.58841090, -0.66610653, -0.21594427, 0.07312529, 0.66683222,
> > 0.00393578, 0.00023171, -0.01911892, -0.00114821, 0.00223544,
> > -0.00033096, 0.00026288, 0.00006998, -0.00003531, 0.00205271,
> > 0.00009146, -0.00049941, -0.00007381, 0.00005157, 0.25117493,
> > 0.22445145, -0.00393472, 0.39529626, 0.07824684, 0.03257635,
> > -0.00541557, -0.01794870, 0.01074580, 0.12937671, 0.02051394,
> > 0.02316950, -0.04000840, 0.11245902, -0.02863697, -0.06880140,
> > -0.04221504, 0.00277319, 0.02202422, -0.02525335, 0.01495055,
> > -0.02127551, -0.02634081, 0.00010026, -0.06863328, 0.00058000,
> > 0.12381287, 0.25676422, 0.00099553, 0.00018799, -0.20037346,
> > -0.00283783, -0.00001880, -0.00002102, 0.00003444, -0.00021715,
> > 0.00074457, -0.00409892, -1.14119497, -0.01884586, 0.12964848,
> > -0.36858557, -0.09261278, 0.00027516, -0.13786263, 0.18874531,
> > 0.69336015, -0.00479973, 0.00034676, 1.54241745, -0.46495054,
> > 0.68126150, 0.85558889, -0.30923567, -1.68852167, -0.13842989,
> > -0.34743101, -0.20682972, -0.76984273, 1.07322981, 0.83730517,
> > -0.00016204, -0.31923551, -0.28878366, 0.00046207, 0.35324229,
> > -0.00018345, 0.44958344, -0.84136469, 0.21243149, 0.00181129,
> > -0.00022253, 0.21118557, 0.22253871, -0.24904275, -0.89922082,
> > 0.00245699, 0.00058027, 0.46463963, -0.21036118, -0.00100082,
> > 0.03118479, -0.11990453, 0.00074373, -0.00166945, 0.00303452,
> > -1.04121094, -0.24280043, 0.14539280, 0.05676975, -0.00060548,
> > -0.42130747, -0.02155766, -0.28570210, -0.24648599, 0.14622814,
> > 0.07784653, -0.25325022, -0.07209970, 0.05888046, 0.12785094,
> > -0.40779763, -0.33165752, 0.12925171, 0.08578775, 0.00059766,
> > -0.20068817, -0.15263960, 0.24139282, -0.61505023, 0.61143412,
> > 0.92184878, -1.01461828, 0.77949222, 0.92439339, -0.94301790,
> > 1.66247015, -2.08305762, -1.14688554, -1.53558238, -5.45644969,
> > -0.99340124, 1.69374904, 0.67433315, -0.33590769, -3.46713653,
> > 0.00000016, 0.00000000, 0.00000998, 0.00000034, 0.00000036,
> > 0.00000046, 0.00000000, -0.00000001, 0.00000004, -0.00000048,
> > -0.00000002, 0.00000001, 0.00000001, -0.00000001, 0.00041463,
> > 0.00017040, -0.00000137, 0.00031814, 0.00007636, 0.00021179,
> > -0.00001997, 0.00048105, -0.00073556, -0.00009488, 0.00033600,
> > -0.00059367, 0.00077772, -0.00012259, -0.00004074, 0.00037814,
> > 0.01123977, 0.33973319, -0.02483666, -0.00019467, -0.00004954,
> > -0.00029299, -0.00008585, -0.06961307, -0.00005970, -0.07300785,
> > 0.00027465, -0.00050088, 0.23385810, -0.32870608, -0.00114377,
> > -0.00004123, 0.02663330, 0.16828723, 0.02325959, 0.01405448,
> > -0.06290661, 0.21853143, 0.00143022, -0.15513322, 0.00015291,
> > -0.00012340, 0.00005994, -0.06457447, -0.00016459, -0.00004786,
> > -0.00036926, -0.00002004, 0.00658140, 0.00052675, 0.00034942,
> > -0.00002424, 0.00062460, 0.00057226, 0.00042722, 0.00010640,
> > 0.00018561, 0.00015577, -0.00078402, -0.00078656, 0.00085234,
> > -0.10608874, 0.00008223, -0.00003405, -0.10751191, -0.00080640,
> > 0.03420642, -0.00030588, 0.00202229, -0.00014398, -0.14456642,
> > -0.05736380, -0.00027324, 0.00045420, -0.00032294, -0.00072137,
> > 0.13538461, -0.13620163, -0.00105278, -0.00154491, 0.43593012,
> > -0.00001445, -0.00033972, 0.14195208, 0.68313959, -0.52087517,
> > -0.00381938, 0.00147993, 0.00010603, -0.00026131, -0.04757667,
> > -0.00034855, -0.00197508, -0.00051023, -0.00007425, 0.00137346,
> > 0.00025984, -0.00029444, -0.00060459, 0.00014973, -0.00006566,
> > 0.00013701, 0.02089721, 0.05543559, -0.00036362, -0.00154057,
> > 0.00028370, 0.00035590, -0.00076402, -0.00132837, 0.00097386,
> > 0.00040619, -0.00025998, 0.00034776, 0.00026865, 0.00049495,
> > -0.00145922, 0.00046271, 0.00013201, 0.00014409, 0.00071300,
> > -0.00012958, -0.00041443, -0.00020569, -0.00003063, -0.00026172,
> > -0.00006061, 0.00000170, 0.00010487, -0.00011072, -0.00008826,
> > -0.00009432, 0.00000268, 0.00000546, -0.00000924, -0.00000216,
> > 0.00000903, -0.00001591, 0.00000332, 0.00000397, -0.01664713,
> > 0.04018343, -0.00013688, -0.00875979, -0.01086332, -0.05430386,
> > 0.00574743, -0.11293398, 0.16597732, -0.09005613, -0.10247916,
> > 0.10190445, -0.23544265, 0.12908453, -0.08283656, 0.09726364,
> > 0.08216984, 0.00113239, 0.04457432, 0.15605172, -0.00080510,
> > 0.00702277, -0.00760811, -0.00025735, -0.00764297, -0.00023382,
> > 0.00590897, -0.01821627, 0.00076237, -0.00131781, 0.20424930,
> > 0.01626538, 0.00008754, 0.00053453, 0.00005133, 0.00001657,
> > -0.00024312, 0.00086971, -0.00991611, -0.00062548, -0.00416710,
> > -0.05199854, -0.02831368, 0.00020936, -0.02503153, 0.03496903,
> > 0.13000202, 0.04669979, -0.00008229, -0.09098423, -0.12301037,
> > 0.00682740, -0.15829265, -0.11346276, -0.18832237, -0.04921402,
> > -0.06110531, -0.08598096, 0.10400904, 0.11091915, -0.17097738,
> > -0.00030835, -0.02657255, -0.09691534, -0.00001022, 0.12062504,
> > 0.00024129, -0.07137339, 0.01548868, 0.06442656, -0.00022040,
> > -0.00001486, -0.06494018, -0.11578709, 0.13941171, 0.25300213,
> > -0.00025196, -0.00068725, 0.06913627, 0.04420219, 0.00172580,
> > -0.00171035, 0.04761281, 0.00030391, 0.00260623, -0.00215856,
> > 0.08753305, -0.15317611, -0.01382603, 0.16257196, -0.00175550,
> > -0.01428128, 0.69330617, 0.08262712, -0.05751296, -0.11073372,
> > -0.06731293, 0.06204947, 0.10249727, -0.01739737, 0.06486005,
> > -0.09624806, -0.15417826, 0.05671338, 0.05854252, -0.00020746,
> > 0.05418485, -0.04543133, 0.17718623, 0.35450084, -0.27575536,
> > -0.15573689, 0.05661629, -0.23401060, -0.14536832, -0.04856155,
> > 0.35722757, -0.05339262, -0.04300168, -0.04411836, -0.07231338,
> > 0.13331193, 0.04464468, 0.02693502, 0.01662286, 0.08475993,
> > 0.00009826, -0.00000001, -0.00051154, -0.00001077, 0.00000858,
> > -0.00012868, -0.00000101, 0.00000095, -0.00000458, 0.00015304,
> > -0.00000075, 0.00001448, -0.00000857, -0.00000456, -0.04573953,
> > -0.04505348, 0.00021716, 0.01596460, 0.00901271, 0.00077181,
> > -0.00180241, -0.04331955, 0.06914899, 0.27678244, 0.03158262,
> > 0.14804039, -0.00159234, -0.23448408, -0.09209600, 0.15334505,
> > 0.11466932, -0.00269780, 0.01672509, -0.05629317, -0.00117947,
> > 0.02535111, 0.05581928, -0.00009826, 0.04978341, -0.00034711,
> > -0.05898460, -0.10962591, -0.00009974, -0.00055786, 0.01841966,
> > -0.00356844, 0.00005146, 0.00030889, 0.00000974, 0.00004682,
> > 0.00004794, -0.00053196, -0.21324608, -0.00374482, -0.01812869,
> > -0.01510368, 0.01067460, -0.00013435, -0.01080940, 0.00054351,
> > -0.08028253, -0.05441144, -0.00008484, -0.13778844, 0.03585490,
> > -0.03019045, -0.09586502, -0.01826463, 0.10563279, -0.00740887,
> > -0.01862895, 0.03932289, 0.09277719, 0.06112218, -0.06795328,
> > 0.00030829, -0.00520413, -0.04153832, 0.00041160, 0.04708961,
> > -0.00020682, 0.05766694, -0.12404883, -0.00116486, 0.00012189,
> > -0.00018606, -0.00353193, 0.04639861, 0.03695576, -0.06659798,
> > 0.00003416, -0.00026197, 0.16695004, -0.02614232, -0.00005328,
> > 0.00925416, 0.05735416, 0.00070459, 0.00067977, -0.00020827,
> > -0.15197141, -0.09400376, -0.03127878, 0.12435064, -0.00025993,
> > -0.02247654, -0.26205277, -0.17841419, 0.07350153, -0.90187582,
> > -0.08418737, 0.08773758, 0.19234145, 0.03471747, -0.03450760,
> > 0.08288808, -0.02245239, 0.00735046, -0.06510255, -0.00010655,
> > 0.03731790, 0.07230001, 0.01000249, 0.09098754, -0.00966807,
> > 0.01471988, 0.13256514, -0.07291426, -0.12805784, 0.20975350,
> > -0.02570005, 0.06243293, 0.09775319, 0.10657099, -0.23885957,
> > -0.29014056, 0.24431211, 0.05819491, -0.02145635, -0.12869200,
> > 0.00000760, 0.00000053, -0.00002959, -0.00000002, 0.00000154,
> > -0.00000774, 0.00000063, 0.00000172, -0.00000033, 0.00000382,
> > 0.00000013, -0.00000129, -0.00000024, 0.00000005, 0.00033334,
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> > 0.70201826, 0.28247290, 0.00107277, 0.28835534, 0.49379368,
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> > 1.25161398, 1.13468839, 0.34673905, 0.97143547, -1.53710096,
> > -1.91536267, -2.12100413, 2.89984507, 3.90143220, -1.87192238,
> > -2.88415021, 1.68315512, 1.37913892, -0.40223754, 1.38195866,
> > -8.53937603, 2.48441374, 0.65812509, -0.65020228, -2.67281065,
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> > 0.00074233, 0.00128646, -0.19889290, 0.19082111, 0.00019764,
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> > -0.00022086, 0.00024686, 0.00014229, -0.00044092, 0.00026067,
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> > -0.00233771, 0.00041448, -0.00023348, 0.00073401, 0.33003164,
> > -0.00033908, 0.00062409, 0.00005742, -0.00037785, 0.00002990,
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> > -1.08312289, 1.54409180, -1.35962286, -3.05152514, 0.83150882,
> > 4.79725389, 1.73573870, 1.12384317, 2.19687185, 3.57664205,
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> > 0.56035552, 0.84790215, 0.49309842, 0.90052083, 2.46581030,
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> > 0.00297119, -0.35574761, -0.55348135, 0.00442001, 0.87644942,
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> > -0.00069711, 0.00025603, 0.49941243, -0.15798650, -0.00143351,
> > 0.04828358, 0.02304210, 0.00198746, 0.00124436, -0.00045712,
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> > 0.51044737, -0.70513649, 0.42880654, 0.40815096, 0.29145500,
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> > 0.54706822, -1.39903884, 0.34701608, 1.35092583, 0.90282976,
> > -4.76365847, 0.88349417, 0.19743234, -0.14060684, 1.32522699,
> > -1.20883357, 1.73938211, 0.59502617, -0.46857052, -2.41416285,
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> > 0.00747110, 0.00865525, 0.01105570, 0.02489248, -0.00008871,
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> > -0.00310554, 0.00689291, 0.00371926, -0.01464526, 0.00194928,
> > -0.00095408, -0.00483740, 0.00184783, 0.01017251, 0.00002672,
> > -0.00932055, 0.00296703, 0.00630899, 0.01202140, -0.00872422,
> > 0.01061261, 0.00503308, 0.00449280, -0.00002236, -0.02328403,
> > 0.02559123, -0.00373238, 0.01029589, 0.02941878, 0.04271627,
> > -0.08400564, 0.02417739, -0.00380815, -0.00207470, 0.01589068,
> > -0.00012431, -0.00008128, -0.00001945, 0.00016556, -0.00012238,
> > 0.00003524, -0.00005528, 0.02514042, 0.00010178, 0.00134362,
> > -0.00009302, 0.00123507, 0.00005146, -0.00017209, 0.01679953,
> > 0.01155734, 0.00350521, -0.08176275, 0.14586029, 0.25620070,
> > 0.00989942, -0.07154735, 0.20172620, 0.01686478, 0.03648524,
> > -0.02543904, 0.11710060, 0.06321189, -0.02041073, -0.07750338,
> > -0.00006108, -0.00015713, -0.00628045, 0.01765710, 0.00195388,
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> > -0.03809425, 0.00584959, -0.00312686, -0.03228477, 0.00848238,
> > 0.00344801, 0.02771979, 0.03837866, -0.01503539, -0.04222400,
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> > 0.72930417, -0.52216709, -1.06484463, 0.26272475, 0.70247913,
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> > -0.00069603, 1.18859274, 0.37664032, -0.00303859, -0.97444436,
> > 0.00182915, 0.76047814, -0.75070941, 0.05506826, 0.00253531,
> > -0.00117944, -0.55271591, 0.96958845, 0.94491029, 0.37845796,
> > -0.00170160, -0.00121310, 0.47118077, 0.23301175, 0.00086589,
> > 0.12512210, 0.40229748, 0.00012294, 0.00096529, 0.00159399,
> > -0.55879670, -0.47204552, -0.66513511, 0.67056275, 0.00200969,
> > 0.32380915, 0.56804732, -0.92451604, -1.10625779, 0.33842781,
> > 1.16216455, 0.85431452, -0.58863004, -0.55388188, -1.66596353,
> > 0.08449024, 0.63671476, -0.22371423, 0.08316023, 0.00678254,
> > -2.80127657, -1.78689320, 2.01250881, -1.21255017, 1.59432470,
> > 3.28608969, -1.13732699, -3.30967414, -2.76301450, 1.02675639,
> > 1.47321084, -1.51877065, -1.23115170, 1.83151396, 1.09273807,
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> > 1.52268755, 0.11453269, -0.76700634, -0.02391440, -0.85865450,
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> > -1.07514246, -0.57929137, 0.06090053, 1.01509599, 0.29518383,
> > 1.72956989, -1.27339870, -0.17532353, 2.30038402, 0.85056870,
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> > -0.36698578, -3.32166975, 7.98151734, -4.74290570, 0.56639873,
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> > -0.39573417, 0.55458494, -0.00003037, -0.00308349, 0.40178447,
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> > -0.00044033, 0.00008298, -0.00113900, 0.00010991, 0.07439742,
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> > -0.00096394, -1.27024707, 2.74664098, -7.45440559, 0.99902795,
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> > 0.00050649, 0.05284997, -0.01243632, 0.12941099, -0.12733368,
> > 0.19674228, 0.14548505, 0.08509229, 0.06074328, -0.14311993,
> > -0.04766988, 0.07947754, 0.05197410, 0.01009810, 0.00140345,
> > 0.07697264, -0.00675208, -0.05721112, -0.00331704, 0.03729351,
> > 0.00862495, -0.00470124, -0.00001588, 0.00146852, 0.00001581,
> > 0.00768322, -0.00592336, -0.00002569, 0.00000708, 0.00088286,
> > 0.05700599, 0.00000694, -0.00000039, -0.00000133, 0.00000188,
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> > -0.00659782, 0.02562498, 0.00002564, 0.00398067, 0.04675865,
> > -0.07990761, 0.03961514, 0.00782570, -0.05817012, -0.04797632,
> > -0.05330708, 0.01318126, 0.08278759, -0.14435855, 0.00491604,
> > -0.00016148, 0.21310020, 0.12092235, -0.00041507, 0.36937311,
> > -0.00052858, 0.35403223, 0.11851851, 0.18264932, 0.00044328,
> > -0.00025584, 0.10255949, -0.22187662, 0.31416976, -0.23626477,
> > 0.00045793, -0.00000234, -0.18315559, -0.27514987, -0.00113528,
> > -0.22690773, 0.12038535, -0.00079007, 0.00030478, -0.00028277,
> > 0.02224188, 0.01812663, 0.34494663, 0.06494260, 0.00040132,
> > 0.44345595, -0.06204079, 0.09853209, -0.73738905, -0.02972805,
> > 0.18261838, 0.28846136, 0.07345504, 0.49297360, -0.21285546,
> > 0.05662723, -0.00473477, 0.00674543, 0.85134718, 0.00167962,
> > -0.58432257, 0.44693644, 0.19600692, -0.16523704, -0.08151408,
> > -0.25960797, 0.42546145, -0.01260593, 0.33045794, -0.00884297,
> > 0.07345725, 0.50922737, 0.68762699, -0.83049638, -0.06762065,
> > -0.19174915, -0.33480036, 0.87813286, -0.65416635, 0.05601758,
> > 0.00100973, 0.00573256, -0.00018983, 0.00032768, 0.00041944,
> > 0.00022205, 0.01209832, 0.00070430, -0.00993916, -0.00098751,
> > 0.00275418, 0.00248760, 0.02129036, -0.00263289, 0.00598477,
> > 0.00897547, -0.00591036, -0.00658983, 0.08895831, -0.09880937,
> > 0.15892504, 0.10091969, 0.03857161, 0.03784814, -0.14166470,
> > -0.02161546, 0.08555240, 0.07115461, -0.00094031, 0.01063095,
> > 0.06033213, -0.00441075, -0.03392802, -0.01533046, 0.04585525,
> > 0.07257139, 0.04527097, -0.00006898, -0.08955129, -0.00018376,
> > 0.02037074, -0.10181925, -0.00042405, 0.00016475, -0.05494241,
> > 0.30883438, -0.00001746, 0.00010250, -0.00001181, -0.00009821,
> > -0.00007355, -0.00016976, -0.05881943, -0.00144559, 0.49763148,
> > 0.49454531, -0.41491134, 0.00488362, -1.10298450, 0.20831038,
> > 0.14424635, 0.92906321, 0.00081103, -0.46453707, 0.90466204,
> > 0.05761524, 0.59396074, 0.71267001, -0.27462838, -1.83999701,
> > 1.15290456, -0.39253025, 1.62741003, 0.53808562, 0.83681077,
> > 0.00606468, -3.97982799, -1.21232437, 0.00423689, -0.25699729,
> > -0.00045899, 1.24869702, 0.50663584, -0.71270229, -0.00422412,
> > -0.00023439, 0.90807390, -1.12503478, -0.68907488, -0.21706082,
> > 0.00069263, -0.00060931, 0.15810506, 0.24811551, 0.00164217,
> > -0.02462966, -0.29926800, 0.00251545, -0.00256655, 0.00251786,
> > -0.63209064, 0.15254368, 1.41513020, 0.61173164, -0.00257112,
> > -0.28190087, 0.06677239, 0.20887551, 2.20045203, 0.03766209,
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> > -0.00156693, 0.00218804, -0.00011372, 0.00277395, 0.00188158,
> > 0.00039249, -0.00281484, 0.00159302, -0.00344243, -0.00167804,
> > -0.00071894, 0.00035836, -0.00045043, 0.00163581, -0.00040695,
> > 0.00029040, -0.00092765, 0.00260765, 0.00428875, -0.00055354,
> > -0.00001096, 0.00084467, -0.00001302, 0.00000321, 0.00001343,
> > 0.00001063, 0.00022291, 0.00004811, 0.00024569, -0.00001736,
> > 0.00021815, 0.00003555, -0.00035236, -0.00031498, -0.00035335,
> > -0.00024307, -0.01309751, 0.00000040, 0.00142354, -0.00023407,
> > -0.00411621, -0.00141289, -0.00179696, -0.00701197, 0.02432823,
> > 0.01923201, -0.00793507, -0.00236988, 0.03153724, -0.04457118,
> > 0.05806513, 0.00078234, 0.03556086, -0.00952646, 0.02422238,
> > 0.07413322, -0.02526624, 0.00039661, -0.04731997, 0.00016721,
> > 0.11092197, -0.09398991, 0.00025030, 0.00060625, -0.04557414,
> > 0.42454039, -0.00001285, 0.00056958, -0.00066427, -0.00057703,
> > 0.00007520, -0.00037022, -0.00054041, -0.00076706, 0.01387938,
> > 0.00664006, 0.00239904, 0.00038730, 0.04394333, 0.01605458,
> > 0.01682859, -0.02291353, 0.00083211, 0.01949549, 0.01231009,
> > 0.07110105, -0.11572513, 0.06813169, 0.01440215, 0.32831638,
> > 0.02374919, -0.09527138, -0.07557390, 0.15668905, -0.11078184,
> > -0.00046617, -0.14034109, 0.41075190, -0.00220092, -0.07286072,
> > 0.00046448, -0.05320860, -0.04962852, 0.01973617, -0.00011635,
> > -0.00009386, 0.05801075, -0.06833148, 0.02151022, 0.00363979,
> > -0.00013234, 0.00009690, 0.07076872, 0.17770544, 0.00117870,
> > -0.12007293, -0.09633683, 0.00077668, -0.00060518, -0.00003458,
> > -0.01442539, -0.00192832, 0.06511773, -0.04554659, 0.00028384,
> > 0.10596024, 0.00275055, -0.06871296, -0.11406294, -0.00016869,
> > -0.09059803, -0.03123259, 0.23575390, -0.03020618, 0.33606449,
> > -0.19547068, 0.16369925, -0.06003762, -0.20989372, -0.00368797,
> > -0.04420112, -0.62180143, -0.01433945, -0.60747162, -0.49008704,
> > 0.30427894, 0.78732457, -0.61888338, 1.00158330, 0.26403492,
> > 0.19269520, 0.12678960, 0.22725661, -0.37075453, 0.08719102,
> > -0.15413227, -0.03154663, 0.15113689, 0.26818200, -0.03955461,
> > -0.00003654, -0.00507184, 0.00002716, 0.00002653, 0.00000238,
> > 0.00003815, -0.00138730, 0.00005830, -0.00008039, 0.00000736,
> > 0.00015015, -0.00005057, 0.00001787, -0.00012294, -0.00045143,
> > -0.00060726, 0.07842435, 0.00135302, -0.00677084, 0.00193247,
> > -0.00095446, 0.00272698, 0.01090262, 0.00295426, 0.01551220,
> > -0.02566921, -0.01721008, -0.00748026, 0.02752002, 0.04844660,
> > -0.03957655, 0.00847177, 0.09975049, -0.02296154, -0.01512866,
> > -0.08358838, -0.14252412, 0.00053682, 0.23600056, 0.00023433,
> > 0.04494828, 0.02063207, 0.00072865, 0.00059001, 0.00192739,
> > 0.07197881, 0.00000766, 0.00060706, -0.00073532, -0.00065419,
> > 0.00012194, -0.00038951, 0.00533973, -0.00070852, -0.04628412,
> > -0.03532822, 0.01393611, 0.00056798, -0.02936230, -0.08289510,
> > 0.01637888, -0.08176223, 0.00080412, -0.01306233, 0.11374973,
> > -0.60038883, 0.25492262, -0.29903033, -0.23974713, -0.03849522,
> > -0.53873520, 0.50596479, -0.05109364, -0.39965982, -0.11989169,
> > -0.00027440, 0.19708582, 0.17871042, -0.00060495, 0.21601311,
> > -0.00000849, -0.09921726, -0.01274092, 0.17993490, 0.00072001,
> > -0.00006678, -0.11705009, 0.09988037, 0.01268051, 0.00766947,
> > -0.00010280, 0.00031689, 0.00925393, 0.13785507, 0.00073534,
> > 0.52898444, -0.01438002, 0.00026664, -0.00026049, -0.00033447,
> > 0.07177418, -0.01384282, -0.33840736, -0.09472541, -0.00015174,
> > -0.61645359, -0.04729470, 0.27171438, 0.14278371, -0.05036602,
> > 0.13052349, 0.25424227, -0.18686572, 0.15359025, 0.38523627,
> > 0.27134712, -0.34940142, 0.13127319, -0.04600995, -0.00283267,
> > -0.47793700, -0.01757869, -0.07825751, -0.26052378, -0.15639530,
> > -0.33899127, 0.11099701, 0.01544967, 0.17878600, 0.30208487,
> > 0.06831900, -0.24296602, -0.05151633, -0.10603009, 0.06044388,
> > 0.02367962, 0.29878550, -0.84875404, -1.61686027, 0.21809232,
>
>
> --
> Prof. Hans-Joachim Werner
> Institute for Theoretical Chemistry
> University of Stuttgart
> Pfaffenwaldring 55
> D-70569 Stuttgart, Germany
> Tel.: (0049) 711 / 685 4400
> Fax.: (0049) 711 / 685 4442
> e-mail: werner at theochem.uni-stuttgart.de
>
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