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	hartrees
Energy at 0K	-574.923867
Energy at 298.15K	-574.927200
HF Energy	-573.584257
Nuclear repulsion energy	356.394056

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3130	3012
2	A'	1452	1398
3	A'	1308	1259
4	A'	1186	1142
5	A'	1119	1077
6	A'	857	825
7	A'	703	677
8	A'	560	539
9	A'	502	483
10	A'	355	342
11	A'	240	231
12	A"	1354	1303
13	A"	1207	1161
14	A"	1130	1088
15	A"	568	546
16	A"	404	389
17	A"	207	199
18	A"	79	76

Atom	x (Å)	y (Å)	z (Å)
C1	0.119	-0.603	0.000
C2	-0.614	0.749	0.000
F3	1.453	-0.439	0.000
F4	-0.233	-1.312	1.097
F5	-0.233	-1.312	-1.097
F6	-0.233	1.449	-1.110
F7	-0.233	1.449	1.110
H8	-1.708	0.615	0.000

	C1	C2	F3	F4	F5	F6	F7	H8
C1		1.5377	1.3445	1.3524	1.3524	2.3594	2.3594	2.1958
C2	1.5377		2.3842	2.3651	2.3651	1.3664	1.3664	1.1023
F3	1.3445	2.3842		2.1930	2.1930	2.7645	2.7645	3.3325
F4	1.3524	2.3651	2.1930		2.1932	3.5342	2.7605	2.6627
F5	1.3524	2.3651	2.1930	2.1932		2.7605	3.5342	2.6627
F6	2.3594	1.3664	2.7645	3.5342	2.7605		2.2205	2.0252
F7	2.3594	1.3664	2.7645	2.7605	3.5342	2.2205		2.0252
H8	2.1958	1.1023	3.3325	2.6627	2.6627	2.0252	2.0252

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	108.525	C1	C2	F7	108.525
C1	C2	H8	111.486	C2	C1	F3	111.448
C2	C1	F4	109.671	C2	C1	F5	109.671
F3	C1	F4	108.812	F3	C1	F5	108.812
F4	C1	F5	108.364	F6	C2	F7	108.695
F6	C2	H8	109.775	F7	C2	H8	109.775

All results from a given calculation for CF₃CHF₂ (pentafluoroethane)

using model chemistry: CCSD(T)/aug-cc-pVDZ

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 CF3CHF2 (pentafluoroethane)

using model chemistry: CCSD(T)/aug-cc-pVDZ

States and conformations

All results from a given calculation for CF₃CHF₂ (pentafluoroethane)