Primitives | Contractions... | ||||
---|---|---|---|---|---|
5.222730 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.275000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
2.160443 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.487073 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.074325 | 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).