Primitives | Contractions... | ||
---|---|---|---|
1455.819700 | -0.000772 | 0.000000 | 0.000000 |
214.453740 | -0.006113 | 0.000000 | 0.000000 |
48.177791 | -0.031375 | 0.000000 | 0.000000 |
13.505697 | -0.116068 | 0.000000 | 0.000000 |
4.286620 | -0.293391 | 0.000000 | 0.000000 |
1.445324 | -0.457522 | 0.000000 | 0.000000 |
0.485906 | -0.262407 | 0.000000 | 0.000000 |
0.834737 | 0.000000 | 0.075146 | 0.000000 |
0.067681 | 0.000000 | -0.652595 | 0.000000 |
0.025446 | 0.000000 | 0.000000 | 1.000000 |
Comment: DZVP2 (DFT Orbital)