Primitives | Contractions... | |||
---|---|---|---|---|
26.630000 | 0.014737 | 0.000000 | 0.000000 | 0.000000 |
5.948000 | 0.091834 | 0.000000 | 0.000000 | 0.000000 |
1.742000 | 0.298685 | 0.000000 | 0.000000 | 0.000000 |
0.555000 | 0.498375 | 1.000000 | 0.000000 | 0.000000 |
0.172500 | 0.337111 | 0.000000 | 1.000000 | 0.000000 |
0.049100 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pVTZ-X2C