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	hartrees
Energy at 0K	-107.995824
Energy at 298.15K	-107.999485
Nuclear repulsion energy	147.080564

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3142	3036	16.19
2	A'	1520	1468	6.95
3	A'	1425	1377	2.73
4	A'	1272	1229	104.75
5	A'	1057	1021	242.56
6	A'	989	955	62.39
7	A'	762	736	37.76
8	A'	586	567	36.94
9	A'	484	468	13.90
10	A'	368	356	1.75
11	A'	205	199	5.69
12	A"	3243	3134	10.22
13	A"	1275	1232	75.78
14	A"	1133	1095	65.75
15	A"	939	908	118.78
16	A"	468	453	3.74
17	A"	322	311	2.09
18	A"	95	92	11.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.354	0.196	0.000
C2	-1.198	0.269	0.000
F3	0.877	1.527	0.000
F4	0.877	-0.458	1.142
F5	0.877	-0.458	-1.142
F6	-1.725	-1.093	0.000
H7	-1.545	0.773	0.918
H8	-1.545	0.773	-0.918

	C1	C2	F3	F4	F5	F6	H7	H8
C1		1.5535	1.4301	1.4164	1.4164	2.4458	2.1864	2.1864
C2	1.5535		2.4267	2.4780	2.4780	1.4605	1.1028	1.1028
F3	1.4301	2.4267		2.2900	2.2900	3.6924	2.6979	2.6979
F4	1.4164	2.4780	2.2900		2.2840	2.9118	2.7266	3.4097
F5	1.4164	2.4780	2.2900	2.2840		2.9118	3.4097	2.7266
F6	2.4458	1.4605	3.6924	2.9118	2.9118		2.0870	2.0870
H7	2.1864	1.1028	2.6979	2.7266	3.4097	2.0870		1.8352
H8	2.1864	1.1028	2.6979	3.4097	2.7266	2.0870	1.8352

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	108.441	C1	C2	H7	109.626
C1	C2	H8	109.626	C2	C1	F3	108.775
C2	C1	F4	113.018	C2	C1	F5	113.018
F3	C1	F4	107.124	F3	C1	F5	107.124
F4	C1	F5	107.463	F6	C2	H7	108.209
F6	C2	H8	108.209	H7	C2	H8	112.627

All results from a given calculation for CF₃CH₂F (1,1,1,2-tetrafluoroethane)

using model chemistry: MP2/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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All results from a given calculation for CF3CH2F (1,1,1,2-tetrafluoroethane)

using model chemistry: MP2/CEP-31G

States and conformations

All results from a given calculation for CF₃CH₂F (1,1,1,2-tetrafluoroethane)