Molecular Orbital Constants for Chloro-fluoromethane (CH2ClF)

MO	B (eV)	U (eV)	N	Q	DblIon	Special	Remarks
1a'	2852.97	3731.1	2	1	Yes	none	none
2a'	716.28	1013.43	2	1	Yes	none	none
3a'	310.16	436.3	2	1	Yes	none	none
4a'	287.65	593.31	2	1	Yes	none	none
5a'	218.75	560.81	2	1	Yes	none	none
6a'	218.67	561.76	2	1	Yes	none	none
1a"	218.67	561.8	2	1	Yes	none	none
7a'	44.64	99.71	2	1	Yes	none	none
8a'	31.06	70.17	2	1	No	3s	none
9a'	23.16	61.69	2	1	No	none	B from OVGF
2a"	18.42	56.29	2	1	No	none	B from OVGF
10a'	18.3	65.42	2	1	No	none	B from OVGF
11a'	17.25	75.17	2	1	No	none	B from OVGF
3a"	14.59	60.95	2	1	No	none	B from OVGF
12a'	13.78	64.07	2	1	No	none	B from OVGF
13a'	12.03	62.15	2	1	No	3p	B from CCSD(T)
4a"	11.66	60.16	2	1	No	3p	B from CCSD(T)