Primitives | Contractions... | |||
---|---|---|---|---|
9.439000 | 0.038164 | 0.000000 | 0.000000 | 0.000000 |
2.002000 | 0.209492 | 0.000000 | 0.000000 | 0.000000 |
0.545600 | 0.508468 | 0.000000 | 0.000000 | 0.000000 |
0.151700 | 0.468919 | 1.000000 | 0.000000 | 0.000000 |
14.557000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.040410 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pCVDZ-X2C