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	hartrees
Energy at 0K	-598.062262
Energy at 298.15K
HF Energy	-597.404508
Nuclear repulsion energy	94.081305

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	3269	3110	4.51	90.16	0.20	0.34
2	A	1327	1263	46.93	1.61	0.55	0.71
3	A	1188	1130	206.24	2.13	0.59	0.74
4	A	888	844	58.43	4.59	0.12	0.22
5	A	766	729	24.34	5.47	0.09	0.17
6	A	417	397	1.40	1.87	0.51	0.67

Atom	x (Å)	y (Å)	z (Å)
C1	0.532	0.546	-0.130
H2	0.712	1.489	0.353
F3	1.513	-0.337	0.026
Cl4	-1.031	-0.102	0.011

	C1	H2	F3	Cl4
C1		1.0740	1.3290	1.6977
H2	1.0740		2.0204	2.3838
F3	1.3290	2.0204		2.5542
Cl4	1.6977	2.3838	2.5542

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	114.025		H2	C1	Cl4	116.845
F3	C1	Cl4	114.557

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

using model chemistry: MP2=FULL/aug-cc-pVTZ

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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