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	hartrees
Energy at 0K	-1194.845703
Energy at 298.15K	-1194.849466
HF Energy	-1194.845703
Nuclear repulsion energy	378.203856

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3323	3019	0.00
2	A_g	1558	1416	0.00
3	A_g	1458	1324	0.00
4	A_g	1245	1131	0.00
5	A_g	1187	1078	0.00
6	A_g	906	823	0.00
7	A_g	562	510	0.00
8	A_g	409	372	0.00
9	A_g	292	265	0.00
10	A_u	3334	3029	15.67
11	A_u	1462	1328	42.51
12	A_u	1363	1238	59.32
13	A_u	1246	1132	331.74
14	A_u	843	766	272.22
15	A_u	439	399	4.05
16	A_u	404	367	37.51
17	A_u	187	170	1.85
18	A_u	80	73	1.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.760
C2	0.000	0.000	0.760
H3	1.003	0.000	-1.152
H4	-1.003	0.000	1.152
F5	-0.657	-1.078	-1.194
F6	0.657	1.078	1.194
Cl7	-0.820	1.449	-1.365
Cl8	0.820	-1.449	1.365

	C1	C2	H3	H4	F5	F6	Cl7	Cl8
C1		1.5203	1.0763	2.1586	1.3351	2.3267	1.7716	2.6997
C2	1.5203		2.1586	1.0763	2.3267	1.3351	2.6997	1.7716
H3	1.0763	2.1586		3.0537	1.9797	2.6046	2.3384	2.9095
H4	2.1586	1.0763	3.0537		2.6046	1.9797	2.9095	2.3384
F5	1.3351	2.3267	1.9797	2.6046		3.4758	2.5380	2.9783
F6	2.3267	1.3351	2.6046	1.9797	3.4758		2.9783	2.5380
Cl7	1.7716	2.6997	2.3384	2.9095	2.5380	2.9783		4.3061
Cl8	2.6997	1.7716	2.9095	2.3384	2.9783	2.5380	4.3061

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	111.324	C1	C2	F6	108.976
C1	C2	Cl8	109.959	C2	C1	H3	111.324
C2	C1	F5	108.976	C2	C1	Cl7	109.959
H3	C1	F5	109.902	H3	C1	Cl7	107.889
H4	C2	F6	109.902	H4	C2	Cl8	107.889
F5	C1	Cl7	108.750	F6	C2	Cl8	108.750

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

using model chemistry: HF/6-311G**

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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Number	Element	Mulliken
1	C	0.197
2	C	0.197
3	H	0.167
4	H	0.167
5	F	-0.280
6	F	-0.280
7	Cl	-0.084
8	Cl	-0.084

	x	y	z
x	4.986	-1.560	0.897
y	-1.560	7.239	-1.666
z	0.897	-1.666	5.494

<r²>	254.321
(<r²>)^1/2	15.947