Primitives | Contractions... | ||||
---|---|---|---|---|---|
1.719153 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.225000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.425192 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.191644 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.078139 | 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).