Primitives | Contractions... | ||
---|---|---|---|
78.961752 | 0.006783 | 0.000000 | 0.000000 |
18.347880 | 0.047898 | 0.000000 | 0.000000 |
5.587189 | 0.179384 | 0.000000 | 0.000000 |
1.901847 | 0.369299 | 0.000000 | 0.000000 |
0.633365 | 0.000000 | 1.000000 | 0.000000 |
0.193346 | 0.000000 | 0.000000 | 1.000000 |
Comment: TZVP (DFT Orbital)