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	hartrees
Energy at 0K	-575.010897
Energy at 298.15K	-575.014328
HF Energy	-573.668782
Nuclear repulsion energy	359.015559

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3138	3043
2	A'	1474	1430
3	A'	1336	1295
4	A'	1222	1185
5	A'	1149	1114
6	A'	874	848
7	A'	724	702
8	A'	579	562
9	A'	522	507
10	A'	365	354
11	A'	246	239
12	A"	1410	1367
13	A"	1248	1210
14	A"	1173	1137
15	A"	585	568
16	A"	417	405
17	A"	213	206
18	A"	76	74

Atom	x (Å)	y (Å)	z (Å)
C1	0.120	-0.603	0.000
C2	-0.604	0.749	0.000
F3	1.445	-0.442	0.000
F4	-0.233	-1.300	1.089
F5	-0.233	-1.300	-1.089
F6	-0.233	1.439	-1.103
F7	-0.233	1.439	1.103
H8	-1.689	0.607	0.000

	C1	C2	F3	F4	F5	F6	F7	H8
C1		1.5329	1.3345	1.3404	1.3404	2.3471	2.3471	2.1765
C2	1.5329		2.3697	2.3495	2.3495	1.3529	1.3529	1.0942
F3	1.3345	2.3697		2.1766	2.1766	2.7515	2.7515	3.3050
F4	1.3404	2.3495	2.1766		2.1774	3.5080	2.7393	2.6352
F5	1.3404	2.3495	2.1766	2.1774		2.7393	3.5080	2.6352
F6	2.3471	1.3529	2.7515	3.5080	2.7393		2.2054	2.0067
F7	2.3471	1.3529	2.7515	2.7393	3.5080	2.2054		2.0067
H8	2.1765	1.0942	3.3050	2.6352	2.6352	2.0067	2.0067

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	108.687	C1	C2	F7	108.687
C1	C2	H8	110.780	C2	C1	F3	111.281
C2	C1	F4	109.528	C2	C1	F5	109.528
F3	C1	F4	108.918	F3	C1	F5	108.918
F4	C1	F5	108.620	F6	C2	F7	109.191
F6	C2	H8	109.732	F7	C2	H8	109.732

All results from a given calculation for CF₃CHF₂ (pentafluoroethane)

using model chemistry: MP4/6-311G**

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: MP4/6-311G**

States and conformations

All results from a given calculation for CF₃CHF₂ (pentafluoroethane)