I J SYM. A SYM. B A B T(IJ, AB)
7 7 3 3 1 1 -0.10864405
7 7 3 3 1 3 -0.05133816
7 7 3 3 3 1 -0.05133816
The virtual orbitals are clear to me but I'm not sure how to determine which orbitals I=7, J=7 refer to since the notation is different from how the HF orbitals are printed.
If anyone knows how these are supposed to be read, please let me know. Thanks in advance!