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	hartrees
Energy at 0K	-474.747851
Energy at 298.15K	-474.751758
HF Energy	-474.747851
Nuclear repulsion energy	268.226030

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	2966	2934	0.00
2	A_g	1409	1394	0.00
3	A_g	1138	1126	0.00
4	A_g	1101	1089	0.00
5	A_g	624	617	0.00
6	A_g	356	352	0.00
7	A_u	1282	1268	44.88
8	A_u	1161	1149	368.38
9	A_u	194	192	1.84
10	A_u	77	76	1.90
11	B_g	1313	1298	0.00
12	B_g	1115	1103	0.00
13	B_g	478	473	0.00
14	B_u	2980	2947	41.64
15	B_u	1260	1247	16.24
16	B_u	1152	1139	199.33
17	B_u	536	531	8.69
18	B_u	387	383	40.37

Atom	x (Å)	y (Å)	z (Å)
C1	-0.242	0.714	0.000
C2	0.242	-0.714	0.000
H3	-1.347	0.766	0.000
H4	1.347	-0.766	0.000
F5	0.242	1.330	1.092
F6	0.242	1.330	-1.092
F7	-0.242	-1.330	1.092
F8	-0.242	-1.330	-1.092

	C1	C2	H3	H4	F5	F6	F7	F8
C1		1.5075	1.1062	2.1713	1.3443	1.3443	2.3173	2.3173
C2	1.5075		2.1713	1.1062	2.3173	2.3173	1.3443	1.3443
H3	1.1062	2.1713		3.0990	2.0093	2.0093	2.6087	2.6087
H4	2.1713	1.1062	3.0990		2.6087	2.6087	2.0093	2.0093
F5	1.3443	2.3173	2.0093	2.6087		2.1846	2.7035	3.4758
F6	1.3443	2.3173	2.0093	2.6087	2.1846		3.4758	2.7035
F7	2.3173	1.3443	2.6087	2.0093	2.7035	3.4758		2.1846
F8	2.3173	1.3443	2.6087	2.0093	3.4758	2.7035	2.1846

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	111.425	C1	C2	F7	108.556
C1	C2	F8	108.556	C2	C1	H3	111.425
C2	C1	F5	108.556	C2	C1	F6	108.556
H3	C1	F5	109.780	H3	C1	F6	109.780
H4	C2	F7	109.780	H4	C2	F8	109.780
F5	C1	F6	108.686	F7	C2	F8	108.686

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

using model chemistry: LSDA/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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Number	Element	Mulliken
1	C	0.218
2	C	0.218
3	H	0.059
4	H	0.059
5	F	-0.138
6	F	-0.138
7	F	-0.138
8	F	-0.138

	x	y	z
x	4.053	-0.012	0.000
y	-0.012	4.158	0.000
z	0.000	0.000	4.223

<r²>	140.846
(<r²>)^1/2	11.868

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

using model chemistry: LSDA/cc-pVTZ

States and conformations

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