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	hartrees
Energy at 0K	-337.611119
Energy at 298.15K
HF Energy	-336.814804
Nuclear repulsion energy	132.068688

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3170	3170
2	A₁	1116	1116
3	A₁	676	676
4	E	1381	1381
4	E	1381	1381
5	E	1148	1148
5	E	1148	1148
6	E	491	491
6	E	491	491

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.344
H2	0.000	0.000	1.443
F3	0.000	1.266	-0.130
F4	1.096	-0.633	-0.130
F5	-1.096	-0.633	-0.130

	C1	H2	F3	F4	F5
C1		1.0988	1.3515	1.3515	1.3515
H2	1.0988		2.0189	2.0189	2.0189
F3	1.3515	2.0189		2.1920	2.1920
F4	1.3515	2.0189	2.1920		2.1920
F5	1.3515	2.0189	2.1920	2.1920

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.544	H2	C1	F4	110.544
H2	C1	F5	110.544	F3	C1	F4	108.377
F3	C1	F5	108.377	F4	C1	F5	108.377

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

using model chemistry: QCISD(T)=FULL/daug-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(T)=FULL/daug-cc-pVDZ

States and conformations

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