MOLPRO Basis Query, element=No, basis=cc-pVDZ-X2C, l=s
Basis No s cc-pVDZ-X2C
| Primitives | Contractions... |
|---|
| 54607762.000000 | 0.004625 | -0.003374 | 0.002227 | -0.000272 | 0.000360 | -0.000152 | 0.000053 | -0.000127 | 0.000000 |
| 14455465.000000 | 0.002910 | -0.002128 | 0.001408 | -0.000172 | 0.000228 | -0.000096 | 0.000034 | -0.000080 | 0.000000 |
| 4871716.500000 | 0.009256 | -0.006769 | 0.004479 | -0.000548 | 0.000725 | -0.000306 | 0.000107 | -0.000255 | 0.000000 |
| 1801513.100000 | 0.009649 | -0.007090 | 0.004712 | -0.000578 | 0.000764 | -0.000323 | 0.000113 | -0.000269 | 0.000000 |
| 717489.490000 | 0.019972 | -0.014714 | 0.009803 | -0.001204 | 0.001590 | -0.000672 | 0.000234 | -0.000560 | 0.000000 |
| 297596.830000 | 0.026427 | -0.019650 | 0.013202 | -0.001631 | 0.002149 | -0.000908 | 0.000317 | -0.000755 | 0.000000 |
| 127748.860000 | 0.046413 | -0.034805 | 0.023554 | -0.002927 | 0.003845 | -0.001625 | 0.000566 | -0.001356 | 0.000000 |
| 56248.098000 | 0.067978 | -0.051863 | 0.035643 | -0.004471 | 0.005855 | -0.002474 | 0.000862 | -0.002051 | 0.000000 |
| 25355.419000 | 0.109565 | -0.085287 | 0.059583 | -0.007577 | 0.009852 | -0.004161 | 0.001450 | -0.003488 | 0.000000 |
| 11670.975000 | 0.156468 | -0.125961 | 0.090589 | -0.011715 | 0.015150 | -0.006402 | 0.002231 | -0.005270 | 0.000000 |
| 5480.225600 | 0.209409 | -0.175753 | 0.130415 | -0.017350 | 0.022104 | -0.009328 | 0.003250 | -0.007919 | 0.000000 |
| 2623.149000 | 0.212319 | -0.183371 | 0.139250 | -0.018506 | 0.023729 | -0.010030 | 0.003501 | -0.007974 | 0.000000 |
| 1279.941300 | 0.152224 | -0.082736 | 0.024428 | 0.001546 | 0.000414 | -0.000175 | 0.000044 | -0.001039 | 0.000000 |
| 624.664450 | 0.101277 | 0.153696 | -0.343748 | 0.085740 | -0.087185 | 0.036629 | -0.012736 | 0.032922 | 0.000000 |
| 317.821300 | 0.105365 | 0.259872 | -0.726940 | 0.210461 | -0.209119 | 0.088255 | -0.030943 | 0.068529 | 0.000000 |
| 166.161720 | 0.062259 | 0.164250 | -0.370004 | 0.110164 | -0.106776 | 0.045024 | -0.015440 | 0.049714 | 0.000000 |
| 84.752241 | 0.067663 | 0.267656 | 0.696964 | -0.605856 | 0.543546 | -0.237916 | 0.082980 | -0.230410 | 0.000000 |
| 45.460218 | 0.055526 | 0.234685 | 0.727761 | -0.709872 | 0.689932 | -0.313215 | 0.111850 | -0.225372 | 0.000000 |
| 21.878472 | 0.010557 | 0.035788 | -0.004348 | 0.581989 | -0.803580 | 0.422859 | -0.154825 | 0.310141 | 0.000000 |
| 12.124837 | 0.000351 | -0.005636 | -0.142912 | 0.750709 | -1.312690 | 0.772253 | -0.278017 | 0.870870 | 0.000000 |
| 5.399331 | 0.000762 | 0.001700 | -0.014455 | 0.181685 | 0.824137 | -0.854104 | 0.325840 | -1.370470 | 0.000000 |
| 2.818491 | -0.000038 | -0.000018 | -0.001861 | 0.068816 | 0.807129 | -0.808476 | 0.335920 | -0.392053 | 0.000000 |
| 0.979240 | 0.000069 | 0.000194 | -0.000242 | 0.009381 | 0.072445 | 0.843888 | -0.449484 | 2.505760 | 0.000000 |
| 0.424524 | -0.000019 | -0.000053 | -0.000053 | -0.000176 | 0.011116 | 0.558013 | -0.419003 | -1.724970 | 0.000000 |
| 0.070020 | 0.000005 | 0.000014 | -0.000005 | 0.000405 | 0.002319 | 0.092847 | 0.780380 | -0.891771 | 0.000000 |
| 0.027948 | -0.000002 | -0.000006 | -0.000001 | -0.000129 | -0.000212 | 0.034679 | 0.386898 | 1.207540 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)