Primitives | Contractions... | |||
---|---|---|---|---|
2.220651 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
1.270625 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.637123 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.298943 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVQZ-PP/MP2Fit: Hill and Platts, JCTC 5, 500 (2009)