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	hartrees
Energy at 0K	-337.842437
Energy at 298.15K
HF Energy	-336.907967
Nuclear repulsion energy	134.189515

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3181	3181	35.54
2	A₁	1176	1176	103.86
3	A₁	719	719	14.65
4	E	1442	1442	64.52
4	E	1442	1442	64.52
5	E	1220	1220	263.33
5	E	1220	1220	263.33
6	E	521	521	3.01
6	E	521	521	3.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.336
H2	0.000	0.000	1.422
F3	0.000	1.246	-0.127
F4	1.079	-0.623	-0.127
F5	-1.079	-0.623	-0.127

	C1	H2	F3	F4	F5
C1		1.0856	1.3293	1.3293	1.3293
H2	1.0856		1.9879	1.9879	1.9879
F3	1.3293	1.9879		2.1580	2.1580
F4	1.3293	1.9879	2.1580		2.1580
F5	1.3293	1.9879	2.1580	2.1580

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.403	H2	C1	F4	110.403
H2	C1	F5	110.403	F3	C1	F4	108.523
F3	C1	F5	108.523	F4	C1	F5	108.523

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

using model chemistry: QCISD/cc-pCVTZ

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: QCISD/cc-pCVTZ

States and conformations

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