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	hartrees
Energy at 0K	-3169.759995
Energy at 298.15K	-3169.764828
HF Energy	-3169.759995
Nuclear repulsion energy	323.257347

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	3367	3057	3.88	81.63	0.24	0.39
2	A	1448	1315	28.68	4.14	0.69	0.82
3	A	1336	1213	105.87	3.50	0.59	0.74
4	A	1229	1116	236.33	2.70	0.73	0.84
5	A	856	777	233.27	8.65	0.69	0.82
6	A	711	645	57.53	16.09	0.17	0.29
7	A	458	416	1.48	5.01	0.25	0.40
8	A	342	311	0.13	3.40	0.51	0.67
9	A	244	221	0.09	5.18	0.52	0.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.567	0.462	0.409
Br2	-1.199	-0.186	-0.028
Cl3	1.827	-0.675	-0.067
F4	0.768	1.623	-0.203
H5	0.611	0.596	1.480

	C1	Br2	Cl3	F4	H5
C1		1.9309	1.7622	1.3278	1.0804
Br2	1.9309		3.0656	2.6783	2.4823
Cl3	1.7622	3.0656		2.5334	2.3421
F4	1.3278	2.6783	2.5334		1.9771
H5	1.0804	2.4823	2.3421	1.9771

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.133	Br2	C1	F4	109.150
Br2	C1	H5	107.664	Cl3	C1	F4	109.341
Cl3	C1	H5	108.575	F4	C1	H5	109.950

All results from a given calculation for CHFClBr (fluorochlorobromomethane)

using model chemistry: HF/cc-pVDZ

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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Number	Element	Mulliken
1	C	0.237
2	Br	-0.039
3	Cl	-0.076
4	F	-0.242
5	H	0.120

	x	y	z	Total
	-0.062	-0.051	1.461	1.464
CHELPG
AIM
ESP

	x	y	z
x	7.118	-0.218	0.110
y	-0.218	4.302	0.345
z	0.110	0.345	3.504

<r²>	178.773
(<r²>)^1/2	13.371