Primitives | Contractions... | |||
---|---|---|---|---|
13.550000 | 0.040011 | 0.000000 | 0.000000 | 0.000000 |
2.917000 | 0.217212 | 0.000000 | 0.000000 | 0.000000 |
0.797300 | 0.510219 | 0.000000 | 0.000000 | 0.000000 |
0.218500 | 0.462269 | 1.000000 | 0.000000 | 0.000000 |
10.239000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.056110 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pwCVDZ-X2C