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	hartrees
Energy at 0K	-335.401406
Energy at 298.15K
HF Energy	-334.949201
Nuclear repulsion energy	130.215016

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3172	3048	58.59
2	A₁	1124	1081	107.59
3	A₁	663	637	22.49
4	E	1480	1423	93.09
4	E	1480	1423	93.09
5	E	1224	1177	157.39
5	E	1224	1177	157.39
6	E	485	466	7.70
6	E	485	466	7.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.349
H2	0.000	0.000	1.436
F3	0.000	1.285	-0.131
F4	1.113	-0.643	-0.131
F5	-1.113	-0.643	-0.131

	C1	H2	F3	F4	F5
C1		1.0874	1.3720	1.3720	1.3720
H2	1.0874		2.0268	2.0268	2.0268
F3	1.3720	2.0268		2.2263	2.2263
F4	1.3720	2.0268	2.2263		2.2263
F5	1.3720	2.0268	2.2263	2.2263

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.468	H2	C1	F4	110.468
H2	C1	F5	110.468	F3	C1	F4	108.456
F3	C1	F5	108.456	F4	C1	F5	108.456

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

using model chemistry: QCISD/3-21G*

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/3-21G*

States and conformations

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