Primitives | Contractions... | ||||
---|---|---|---|---|---|
1.173542 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.825000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.246421 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.105941 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.042028 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R.A. Shaw and J.G. Hill, J. Chem. Theory Comput. 13, 1691 (2017).