Primitives | Contractions... | |||
---|---|---|---|---|
12.050000 | 0.013118 | 0.000000 | 0.000000 | 0.000000 |
2.613000 | 0.079896 | 0.000000 | 0.000000 | 0.000000 |
0.747500 | 0.277275 | 0.000000 | 0.000000 | 0.000000 |
0.238500 | 0.504270 | 1.000000 | 0.000000 | 0.000000 |
0.076980 | 0.353680 | 0.000000 | 1.000000 | 0.000000 |
0.020960 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVTZ