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	hartrees
Energy at 0K	-337.604751
Energy at 298.15K
HF Energy	-336.812063
Nuclear repulsion energy	131.932656

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3173	3078
2	A₁	1111	1077
3	A₁	668	648
4	E	1373	1332
4	E	1373	1332
5	E	1144	1110
5	E	1144	1110
6	E	486	471
6	E	483	469

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.347
H2	0.000	0.000	1.445
F3	0.000	1.266	-0.131
F4	1.097	-0.633	-0.131
F5	-1.097	-0.633	-0.131

	C1	H2	F3	F4	F5
C1		1.0987	1.3532	1.3532	1.3532
H2	1.0987		2.0216	2.0216	2.0216
F3	1.3532	2.0216		2.1933	2.1933
F4	1.3532	2.0216	2.1933		2.1933
F5	1.3532	2.0216	2.1933	2.1933

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.644	H2	C1	F4	110.644
H2	C1	F5	110.644	F3	C1	F4	108.273
F3	C1	F5	108.273	F4	C1	F5	108.273

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

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

States and conformations

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