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	hartrees
Energy at 0K	-595.520170
Energy at 298.15K
HF Energy	-595.407202
Nuclear repulsion energy	91.816941

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	3229	3229	13.40	86.87	0.27	0.43
2	A	1353	1353	44.86	7.29	0.71	0.83
3	A	1175	1175	121.35	3.81	0.45	0.62
4	A	840	840	59.55	6.29	0.62	0.77
5	A	681	681	42.35	11.53	0.16	0.28
6	A	384	384	1.65	3.83	0.65	0.79

Atom	x (Å)	y (Å)	z (Å)
C1	0.538	0.558	-0.125
H2	0.687	1.524	0.338
F3	1.560	-0.339	0.026
Cl4	-1.056	-0.107	0.011

	C1	H2	F3	Cl4
C1		1.0814	1.3682	1.7326
H2	1.0814		2.0808	2.4095
F3	1.3682	2.0808		2.6271
Cl4	1.7326	2.4095	2.6271

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	115.818		H2	C1	Cl4	115.856
F3	C1	Cl4	115.319

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

using model chemistry: B2PLYP=FULLultrafine/3-21G*

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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