Primitives | Contractions... | ||||
---|---|---|---|---|---|
3.277494 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.112500 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.866621 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.311536 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.105251 | 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).