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	hartrees
Energy at 0K	-337.737212
Energy at 298.15K
HF Energy	-336.908512
Nuclear repulsion energy	133.865816

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3198	3030	36.38
2	A₁	1176	1114	116.77
3	A₁	722	684	16.57
4	E	1461	1385	72.94
4	E	1461	1385	72.94
5	E	1213	1149	294.07
5	E	1213	1149	294.07
6	E	525	498	3.60
6	E	525	498	3.60

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.337
H2	0.000	0.000	1.424
F3	0.000	1.249	-0.128
F4	1.082	-0.624	-0.128
F5	-1.082	-0.624	-0.128

	C1	H2	F3	F4	F5
C1		1.0866	1.3327	1.3327	1.3327
H2	1.0866		1.9917	1.9917	1.9917
F3	1.3327	1.9917		2.1633	2.1633
F4	1.3327	1.9917	2.1633		2.1633
F5	1.3327	1.9917	2.1633	2.1633

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.413	H2	C1	F4	110.413
H2	C1	F5	110.413	F3	C1	F4	108.514
F3	C1	F5	108.514	F4	C1	F5	108.514

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

using model chemistry: CCSD=FULL/TZVP

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: CCSD=FULL/TZVP

States and conformations

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