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	hartrees
Energy at 0K	-3167.779256
Energy at 298.15K	-3167.783960
HF Energy	-3167.233442
Nuclear repulsion energy	321.217074

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	3233	3049	3.66	72.72	0.27	0.43
2	A	1376	1298	22.54	6.04	0.75	0.86
3	A	1284	1211	81.11	4.84	0.66	0.80
4	A	1134	1069	169.02	1.51	0.73	0.84
5	A	822	775	185.22	4.10	0.64	0.78
6	A	673	635	62.50	10.25	0.15	0.27
7	A	432	408	1.62	4.00	0.29	0.45
8	A	315	297	0.11	3.01	0.52	0.69
9	A	234	221	0.09	4.39	0.52	0.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.580	0.454	0.419
Br2	-1.205	-0.183	-0.029
Cl3	1.823	-0.687	-0.069
F4	0.786	1.643	-0.204
H5	0.617	0.591	1.497

	C1	Br2	Cl3	F4	H5
C1		1.9474	1.7561	1.3581	1.0872
Br2	1.9474		3.0696	2.7071	2.4988
Cl3	1.7561	3.0696		2.5544	2.3535
F4	1.3581	2.7071	2.5544		2.0069
H5	1.0872	2.4988	2.3535	2.0069

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	111.851	Br2	C1	F4	108.651
Br2	C1	H5	107.448	Cl3	C1	F4	109.554
Cl3	C1	H5	109.473	F4	C1	H5	109.827

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

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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