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	hartrees
Energy at 0K	-337.632027
Energy at 298.15K
HF Energy	-336.789668
Nuclear repulsion energy	134.430827

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3170	3003	41.55
2	A₁	1187	1124	96.89
3	A₁	721	683	13.99
4	E	1461	1385	75.63
4	E	1461	1385	75.63
5	E	1243	1177	216.47
5	E	1243	1177	216.47
6	E	519	492	3.07
6	E	519	492	3.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.336
H2	0.000	0.000	1.426
F3	0.000	1.243	-0.127
F4	1.077	-0.622	-0.127
F5	-1.077	-0.622	-0.127

	C1	H2	F3	F4	F5
C1		1.0907	1.3266	1.3266	1.3266
H2	1.0907		1.9898	1.9898	1.9898
F3	1.3266	1.9898		2.1533	2.1533
F4	1.3266	1.9898	2.1533		2.1533
F5	1.3266	1.9898	2.1533	2.1533

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.423	H2	C1	F4	110.423
H2	C1	F5	110.423	F3	C1	F4	108.503
F3	C1	F5	108.503	F4	C1	F5	108.503

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

using model chemistry: QCISD/6-31G(2df,p)

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/6-31G(2df,p)

States and conformations

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