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	hartrees
Energy at 0K	-337.576744
Energy at 298.15K
HF Energy	-336.812645
Nuclear repulsion energy	132.226431

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3195	3095	22.17
2	A₁	1124	1089	95.01
3	A₁	680	659	13.51
4	E	1386	1342	49.49
4	E	1386	1342	49.49
5	E	1162	1126	280.57
5	E	1162	1126	280.57
6	E	493	478	2.71
6	E	493	478	2.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.346
H2	0.000	0.000	1.444
F3	0.000	1.263	-0.130
F4	1.094	-0.632	-0.130
F5	-1.094	-0.632	-0.130

	C1	H2	F3	F4	F5
C1		1.0980	1.3501	1.3501	1.3501
H2	1.0980		2.0182	2.0182	2.0182
F3	1.3501	2.0182		2.1884	2.1884
F4	1.3501	2.0182	2.1884		2.1884
F5	1.3501	2.0182	2.1884	2.1884

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.637	H2	C1	F4	110.637
H2	C1	F5	110.637	F3	C1	F4	108.281
F3	C1	F5	108.281	F4	C1	F5	108.281

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

using model chemistry: QCISD/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

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