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	hartrees
Energy at 0K	-1196.327944
Energy at 298.15K	-1196.331440
HF Energy	-1194.904890
Nuclear repulsion energy	376.855744

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3143	3027
2	A_g	1414	1362
3	A_g	1320	1271
4	A_g	1148	1105
5	A_g	1091	1051
6	A_g	841	810
7	A_g	521	501
8	A_g	377	363
9	A_g	272	262
10	A_u	3156	3039
11	A_u	1338	1288
12	A_u	1242	1196
13	A_u	1131	1089
14	A_u	793	763
15	A_u	404	389
16	A_u	367	354
17	A_u	174	167
18	A_u	76	74

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.759
C2	0.000	0.000	0.759
H3	1.010	0.000	-1.149
H4	-1.010	0.000	1.149
F5	-0.669	-1.096	-1.201
F6	0.669	1.096	1.201
Cl7	-0.819	1.461	-1.342
Cl8	0.819	-1.461	1.342

	C1	C2	H3	H4	F5	F6	Cl7	Cl8
C1		1.5174	1.0829	2.1587	1.3579	2.3428	1.7732	2.6864
C2	1.5174		2.1587	1.0829	2.3428	1.3579	2.6864	1.7732
H3	1.0829	2.1587		3.0598	2.0056	2.6154	2.3485	2.8940
H4	2.1587	1.0829	3.0598		2.6154	2.0056	2.8940	2.3485
F5	1.3579	2.3428	2.0056	2.6154		3.5160	2.5648	2.9686
F6	2.3428	1.3579	2.6154	2.0056	3.5160		2.9686	2.5648
Cl7	1.7732	2.6864	2.3485	2.8940	2.5648	2.9686		4.2917
Cl8	2.6864	1.7732	2.8940	2.3485	2.9686	2.5648	4.2917

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	111.133	C1	C2	F6	109.003
C1	C2	Cl8	109.203	C2	C1	H3	111.133
C2	C1	F5	109.003	C2	C1	Cl7	109.203
H3	C1	F5	110.000	H3	C1	Cl7	108.193
H4	C2	F6	110.000	H4	C2	Cl8	108.193
F5	C1	Cl7	109.281	F6	C2	Cl8	109.281

All results from a given calculation for CHFClCHClF (ethane, 1,2-dichloro-1,2-difluoro-)

using model chemistry: MP4=FULL/cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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