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	hartrees
Energy at 0K	-107.610460
Energy at 298.15K	-107.614666
HF Energy	-107.610460
Nuclear repulsion energy	151.832579

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3367	3024	0.00
2	A_g	1649	1481	0.00
3	A_g	1274	1144	0.00
4	A_g	1208	1084	0.00
5	A_g	678	609	0.00
6	A_g	389	349	0.00
7	A_u	1493	1341	86.69
8	A_u	1290	1158	485.63
9	A_u	221	199	3.47
10	A_u	88	79	3.41
11	B_g	1523	1368	0.00
12	B_g	1260	1132	0.00
13	B_g	523	470	0.00
14	B_u	3379	3034	88.11
15	B_u	1439	1292	55.28
16	B_u	1246	1119	307.66
17	B_u	588	528	14.60
18	B_u	444	399	64.93

Atom	x (Å)	y (Å)	z (Å)
C1	-0.245	0.726	0.000
C2	0.245	-0.726	0.000
H3	-1.328	0.797	0.000
H4	1.328	-0.797	0.000
F5	0.245	1.344	1.086
F6	0.245	1.344	-1.086
F7	-0.245	-1.344	1.086
F8	-0.245	-1.344	-1.086

	C1	C2	H3	H4	F5	F6	F7	F8
C1		1.5335	1.0857	2.1903	1.3419	1.3419	2.3382	2.3382
C2	1.5335		2.1903	1.0857	2.3382	2.3382	1.3419	1.3419
H3	1.0857	2.1903		3.0985	1.9885	1.9885	2.6340	2.6340
H4	2.1903	1.0857	3.0985		2.6340	2.6340	1.9885	1.9885
F5	1.3419	2.3382	1.9885	2.6340		2.1713	2.7330	3.4905
F6	1.3419	2.3382	1.9885	2.6340	2.1713		3.4905	2.7330
F7	2.3382	1.3419	2.6340	1.9885	2.7330	3.4905		2.1713
F8	2.3382	1.3419	2.6340	1.9885	3.4905	2.7330	2.1713

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	112.372	C1	C2	F7	108.632
C1	C2	F8	108.632	C2	C1	H3	112.372
C2	C1	F5	108.632	C2	C1	F6	108.632
H3	C1	F5	109.548	H3	C1	F6	109.548
H4	C2	F7	109.548	H4	C2	F8	109.548
F5	C1	F6	108.005	F7	C2	F8	108.005

All results from a given calculation for CHF₂CHF₂ (1,1,2,2-tetrafluoroethane)

using model chemistry: HF/CEP-31G*

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	0.304
2	C	0.304
3	H	0.165
4	H	0.165
5	F	-0.234
6	F	-0.234
7	F	-0.234
8	F	-0.234

	x	y	z
x	3.061	0.032	0.000
y	0.032	3.181	0.000
z	0.000	0.000	3.313

<r²>	115.577
(<r²>)^1/2	10.751

All results from a given calculation for CHF2CHF2 (1,1,2,2-tetrafluoroethane)

using model chemistry: HF/CEP-31G*

States and conformations

All results from a given calculation for CHF₂CHF₂ (1,1,2,2-tetrafluoroethane)