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	hartrees
Energy at 0K	-44.688632
Energy at 298.15K
HF Energy	-44.491502
Nuclear repulsion energy	33.344656

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3232	3123	26.39	104.52	0.25	0.40
2	A	1279	1236	44.33	5.76	0.73	0.84
3	A	1032	997	208.46	5.37	0.59	0.74
4	A	879	850	15.30	3.22	0.61	0.76
5	A	746	721	65.73	21.07	0.25	0.40
6	A	362	350	3.53	6.65	0.66	0.79

Atom	x (Å)	y (Å)	z (Å)
C1	0.569	0.592	-0.145
H2	0.759	1.520	0.415
F3	1.606	-0.359	0.028
Cl4	-1.096	-0.108	0.012

	C1	H2	F3	Cl4
C1		1.1004	1.4186	1.8127
H2	1.1004		2.0974	2.5012
F3	1.4186	2.0974		2.7136
Cl4	1.8127	2.5012	2.7136

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	112.119		H2	C1	Cl4	116.161
F3	C1	Cl4	113.674

All results from a given calculation for CHFCl (Chlorofluoromethyl radical)

using model chemistry: MP2/CEP-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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