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	hartrees
Energy at 0K	-337.458173
Energy at 298.15K
HF Energy	-336.784863
Nuclear repulsion energy	132.398363

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3272	3073	24.91	64.91	0.21	0.35
2	A₁	1143	1073	102.44	6.06	0.01	0.02
3	A₁	688	646	14.29	1.78	0.32	0.49
4	E	1423	1336	59.11	3.13	0.75	0.86
4	E	1423	1336	59.11	3.13	0.75	0.86
5	E	1171	1100	316.42	2.51	0.75	0.86
5	E	1171	1100	316.42	2.51	0.75	0.86
6	E	498	468	3.18	1.16	0.75	0.86
6	E	498	468	3.18	1.16	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.345
H2	0.000	0.000	1.428
F3	0.000	1.263	-0.129
F4	1.094	-0.631	-0.129
F5	-1.094	-0.631	-0.129

	C1	H2	F3	F4	F5
C1		1.0839	1.3489	1.3489	1.3489
H2	1.0839		2.0055	2.0055	2.0055
F3	1.3489	2.0055		2.1873	2.1873
F4	1.3489	2.0055	2.1873		2.1873
F5	1.3489	2.0055	2.1873	2.1873

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.575	H2	C1	F4	110.575
H2	C1	F5	110.575	F3	C1	F4	108.345
F3	C1	F5	108.345	F4	C1	F5	108.345

All results from a given calculation for CHF₃ (Methane, trifluoro-)

using model chemistry: MP2=FULL/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 CHF3 (Methane, trifluoro-)

using model chemistry: MP2=FULL/6-31+G**

States and conformations

All results from a given calculation for CHF₃ (Methane, trifluoro-)