Primitives | Contractions... | |||
---|---|---|---|---|
6.453130 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
1.739670 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.747295 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.402604 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVTZ-PP/MP2Fit: C. Hattig et al., PCCP 14, 6549 (2012)