Molpro2000.6 problem

[Tony Scott]

One of our group members has the following input deck:

   ***,ccsd/MTA'V5Z//CCSD(T)/cc-pVQZ Magnesium Dihydroxide Mg(OH)2 C2
  memory,75.0,M;
  BASIS
  h=v5z
  spdfgh,o,av5z
  p,O,195.5*3
  d,O,5.879*3,5.879*9,5.879*27
  f,O,4.016*3,4.016*9
  g,O,3.35*3
  spdfgh,Mg,v5z
  p,Mg,.14410000E+04*3
  d,Mg,0.11710000E+01*3
  d,Mg,0.11710000E+01*9
  d,Mg,0.11710000E+01*27
  f,Mg,0.4480000*3
  g,Mg,0.444*3
  END

  GEOMETRY
  UNITS=ANGSTROM
  MG,0,      0.000000,    0.000000,    0.000000
  O,0,       0.000000,    1.775014,    0.000000
  O,0,       0.000000,   -1.775014,    0.000000
  H,0,       0.401475,    2.632372,    0.000000
  H,0,      -0.401475,   -2.632372,    0.000000
  ENDG
  int;
  rhf;
  accu,12;
  maxit,150;
  ccsd;
  ---

which gives the following output and error:

>  mxmblk= 32  mxmbln= 32  ncache=  8192  noblas=0  nroll=3

>                                          ***  PROGRAM SYSTEM MOLPRO  ***
>                                       Copyright, University of 
> Birmingham, 1997
>
>                                     Version 2000.6 linked 23 Apr 2001 
> 12:17:16
>
>
>  
> *************************************************************************
> *********************************************************
>  LABEL *   CCSD/MTA'V5Z//CCSD(T)/CC-PVQZ MAGNESIUM DIHYDROXIDE MG(OH)2 
> C2
>  OSF1-V5.1/sc37(alpha)    64 bit 
> Version                                                 DATE:  
> 28-Sep-01         TIME: 11:28:44
>  
> *************************************************************************
> *********************************************************
>
>  Installed patches: bccd f77fix fujitsu ibmconf1 tripudec varfreq2
>
>
>  Modules:           bench direct doc local
>  
> *************************************************************************
> *********************************************************
>
>  Variable memory set to   75000000 words,  buffer space   158000 words
>
>
>
>  Using spherical harmonics
>
>  Library entry MG     S V5Z                  selected for orbital 
> group  1
>  Library entry MG     P V5Z                  selected for orbital 
> group  1
>  Library entry MG     D V5Z                  selected for orbital 
> group  1
>  Library entry MG     F V5Z                  selected for orbital 
> group  1
>  Library entry MG     G V5Z                  selected for orbital 
> group  1
>  Library entry MG     H V5Z                  selected for orbital 
> group  1
>  Library entry O      S AV5Z                 selected for orbital 
> group  2
>  Library entry O      P AV5Z                 selected for orbital 
> group  2
>  Library entry O      D AV5Z                 selected for orbital 
> group  2
>  Library entry O      F AV5Z                 selected for orbital 
> group  2
>  Library entry O      G AV5Z                 selected for orbital 
> group  2
>  Library entry O      H AV5Z                 selected for orbital 
> group  2
>  Library entry H      S cc-pV5Z              selected for orbital 
> group  3
>  Library entry H      P cc-pV5Z              selected for orbital 
> group  3
>  Library entry H      D cc-pV5Z              selected for orbital 
> group  3
>  mxgrp too small in binput
>
>  ERROR EXIT


It appears as though the error originates in argos/binput.f file of the 
source.

Is this a problem that can be fixed with re-compilation or is there a 
Molpro directive that can be used to increase the size of mxgrp.

Thanking you in advance.

tony


_______________________________________________________
Dr. Anthony P. Scott,
Computational Quantum Chemistry Gp,	Office Ph.: 	61-2-6125-3573
Research School of Chemistry,		Dept. Ph.:  	61-2-6125-3637
Australian National University,			Fax: 			61-2-6125-0750
Canberra, ACT 0200,				
AUSTRALIA.

E-mail: 	Anthony.Scott at anu.edu.au
_______________________________________________________