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	hartrees
Energy at 0K	-598.110250
Energy at 298.15K
HF Energy	-597.393103
Nuclear repulsion energy	94.297156

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	3246	3060	4.69	86.94	0.22	0.35
2	A	1334	1258	47.85	1.62	0.63	0.78
3	A	1194	1126	203.00	2.18	0.54	0.70
4	A	895	843	61.95	4.34	0.14	0.24
5	A	769	725	21.19	5.07	0.10	0.17
6	A	422	398	1.51	1.84	0.53	0.69

Atom	x (Å)	y (Å)	z (Å)
C1	0.530	0.544	-0.130
H2	0.711	1.493	0.351
F3	1.509	-0.336	0.026
Cl4	-1.028	-0.102	0.011

	C1	H2	F3	Cl4
C1		1.0792	1.3260	1.6921
H2	1.0792		2.0220	2.3838
F3	1.3260	2.0220		2.5479
Cl4	1.6921	2.3838	2.5479

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	114.034		H2	C1	Cl4	116.938
F3	C1	Cl4	114.633

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

using model chemistry: MP2=FULL/6-311+G(3df,2p)

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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