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	hartrees
Energy at 0K	-472.766098
Energy at 298.15K	-472.769990
Nuclear repulsion energy	266.382434

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3094	3001
2	A'	1586	1538
3	A'	1480	1435
4	A'	1312	1272
5	A'	1238	1200
6	A'	1089	1056
7	A'	813	788
8	A'	626	607
9	A'	521	505
10	A'	390	378
11	A'	193	187
12	A"	3143	3048
13	A"	1388	1346
14	A"	1227	1190
15	A"	1035	1004
16	A"	504	488
17	A"	329	319
18	A"	110	107

Atom	x (Å)	y (Å)	z (Å)
C1	0.360	0.196	0.000
C2	-1.156	0.257	0.000
F3	0.843	1.492	0.000
F4	0.843	-0.450	1.116
F5	0.843	-0.450	-1.116
F6	-1.671	-1.070	0.000
H7	-1.479	0.795	0.896
H8	-1.479	0.795	-0.896

	C1	C2	F3	F4	F5	F6	H7	H8
C1		1.5169	1.3837	1.3769	1.3769	2.3931	2.1319	2.1319
C2	1.5169		2.3499	2.3960	2.3960	1.4235	1.0940	1.0940
F3	1.3837	2.3499		2.2400	2.2400	3.5898	2.5853	2.5853
F4	1.3769	2.3960	2.2400		2.2321	2.8199	2.6444	3.3155
F5	1.3769	2.3960	2.2400	2.2321		2.8199	3.3155	2.6444
F6	2.3931	1.4235	3.5898	2.8199	2.8199		2.0778	2.0778
H7	2.1319	1.0940	2.5853	2.6444	3.3155	2.0778		1.7918
H8	2.1319	1.0940	2.5853	3.3155	2.6444	2.0778	1.7918

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	108.912	C1	C2	H7	108.393
C1	C2	H8	108.393	C2	C1	F3	108.129
C2	C1	F4	111.693	C2	C1	F5	111.693
F3	C1	F4	108.466	F3	C1	F5	108.466
F4	C1	F5	108.298	F6	C2	H7	110.565
F6	C2	H8	110.565	H7	C2	H8	109.949

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

using model chemistry: MP4/3-21G

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: MP4/3-21G

States and conformations

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