Primitives | Contractions... | |||
---|---|---|---|---|
2.614051 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
1.560622 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.767880 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.314497 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVQZ-PP/MP2Fit: Hill and Platts, JCTC 5, 500 (2009)