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	hartrees
Energy at 0K	-476.693786
Energy at 298.15K	-476.697592
HF Energy	-476.693786
Nuclear repulsion energy	262.466224

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	2995	2972	0.00
2	A_g	1416	1405	0.00
3	A_g	1100	1092	0.00
4	A_g	1078	1070	0.00
5	A_g	593	589	0.00
6	A_g	342	340	0.00
7	A_u	1335	1324	41.53
8	A_u	1098	1090	342.83
9	A_u	192	191	1.87
10	A_u	79	78	1.58
11	B_g	1361	1350	0.00
12	B_g	1066	1057	0.00
13	B_g	462	459	0.00
14	B_u	3005	2982	73.42
15	B_u	1285	1275	29.37
16	B_u	1087	1079	192.85
17	B_u	510	506	6.75
18	B_u	398	395	39.65

Atom	x (Å)	y (Å)	z (Å)
C1	-0.247	0.728	0.000
C2	0.247	-0.728	0.000
H3	-1.350	0.786	0.000
H4	1.350	-0.786	0.000
F5	0.247	1.358	1.120
F6	0.247	1.358	-1.120
F7	-0.247	-1.358	1.120
F8	-0.247	-1.358	-1.120

	C1	C2	H3	H4	F5	F6	F7	F8
C1		1.5370	1.1037	2.2005	1.3772	1.3772	2.3672	2.3672
C2	1.5370		2.2005	1.1037	2.3672	2.3672	1.3772	1.3772
H3	1.1037	2.2005		3.1238	2.0327	2.0327	2.6583	2.6583
H4	2.2005	1.1037	3.1238		2.6583	2.6583	2.0327	2.0327
F5	1.3772	2.3672	2.0327	2.6583		2.2397	2.7608	3.5551
F6	1.3772	2.3672	2.0327	2.6583	2.2397		3.5551	2.7608
F7	2.3672	1.3772	2.6583	2.0327	2.7608	3.5551		2.2397
F8	2.3672	1.3772	2.6583	2.0327	3.5551	2.7608	2.2397

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	111.833	C1	C2	F7	108.523
C1	C2	F8	108.523	C2	C1	H3	111.833
C2	C1	F5	108.523	C2	C1	F6	108.523
H3	C1	F5	109.545	H3	C1	F6	109.545
H4	C2	F7	109.545	H4	C2	F8	109.545
F5	C1	F6	108.813	F7	C2	F8	108.813

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

using model chemistry: BLYP/6-31G**

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	0.407
2	C	0.407
3	H	0.093
4	H	0.093
5	F	-0.250
6	F	-0.250
7	F	-0.250
8	F	-0.250

	x	y	z
x	3.628	-0.021	0.000
y	-0.021	3.713	0.000
z	0.000	0.000	3.815

<r²>	145.707
(<r²>)^1/2	12.071

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

using model chemistry: BLYP/6-31G**

States and conformations

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