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	hartrees
Energy at 0K	-337.407092
Energy at 298.15K
HF Energy	-336.768955
Nuclear repulsion energy	132.751174

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3235	3050	47.42	57.76	0.22	0.36
2	A₁	1170	1103	107.11	4.10	0.00	0.01
3	A₁	702	662	14.31	1.62	0.41	0.58
4	E	1464	1381	83.95	3.86	0.75	0.86
4	E	1464	1381	83.95	3.86	0.75	0.86
5	E	1216	1147	243.78	3.13	0.75	0.86
5	E	1216	1147	243.78	3.13	0.75	0.86
6	E	503	475	3.52	1.16	0.75	0.86
6	E	503	475	3.52	1.16	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.341
H2	0.000	0.000	1.430
F3	0.000	1.260	-0.129
F4	1.091	-0.630	-0.129
F5	-1.091	-0.630	-0.129

	C1	H2	F3	F4	F5
C1		1.0887	1.3445	1.3445	1.3445
H2	1.0887		2.0042	2.0042	2.0042
F3	1.3445	2.0042		2.1816	2.1816
F4	1.3445	2.0042	2.1816		2.1816
F5	1.3445	2.0042	2.1816	2.1816

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.471	H2	C1	F4	110.471
H2	C1	F5	110.471	F3	C1	F4	108.453
F3	C1	F5	108.453	F4	C1	F5	108.453

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

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

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