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	hartrees
Energy at 0K	-475.654400
Energy at 298.15K	-475.658477
Nuclear repulsion energy	271.297214

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3168	2985	11.36
2	A'	1550	1460	6.77
3	A'	1498	1411	17.44
4	A'	1350	1272	140.98
5	A'	1237	1166	277.49
6	A'	1139	1073	95.92
7	A'	861	811	20.37
8	A'	668	630	36.08
9	A'	549	517	10.53
10	A'	414	390	0.85
11	A'	222	209	3.67
12	A"	3241	3054	6.62
13	A"	1355	1277	158.43
14	A"	1240	1169	78.81
15	A"	1013	955	59.42
16	A"	531	501	3.15
17	A"	357	336	1.59
18	A"	118	112	7.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.357	0.194	0.000
C2	-1.157	0.244	0.000
F3	0.838	1.458	0.000
F4	0.838	-0.434	1.087
F5	0.838	-0.434	-1.087
F6	-1.648	-1.050	0.000
H7	-1.496	0.758	0.897
H8	-1.496	0.758	-0.897

	C1	C2	F3	F4	F5	F6	H7	H8
C1		1.5149	1.3520	1.3444	1.3444	2.3594	2.1343	2.1343
C2	1.5149		2.3354	2.3709	2.3709	1.3835	1.0882	1.0882
F3	1.3520	2.3354		2.1815	2.1815	3.5309	2.5964	2.5964
F4	1.3444	2.3709	2.1815		2.1742	2.7822	2.6270	3.2869
F5	1.3444	2.3709	2.1815	2.1742		2.7822	3.2869	2.6270
F6	2.3594	1.3835	3.5309	2.7822	2.7822		2.0237	2.0237
H7	2.1343	1.0882	2.5964	2.6270	3.2869	2.0237		1.7949
H8	2.1343	1.0882	2.5964	3.2869	2.6270	2.0237	1.7949

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	108.900	C1	C2	H7	109.052
C1	C2	H8	109.052	C2	C1	F3	108.966
C2	C1	F4	111.896	C2	C1	F5	111.896
F3	C1	F4	108.007	F3	C1	F5	108.007
F4	C1	F5	107.921	F6	C2	H7	109.340
F6	C2	H8	109.340	H7	C2	H8	111.123

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

using model chemistry: CCD/6-31+G**

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: CCD/6-31+G**

States and conformations

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