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	hartrees
Energy at 0K	-3068.850247
Energy at 298.15K	-3068.855563
HF Energy	-3068.395390
Nuclear repulsion energy	218.238912

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3243	3243	5.47
2	A'	1527	1527	0.63
3	A'	1324	1324	64.04
4	A'	797	797	77.69
5	A'	630	630	23.83
6	A'	239	239	0.30
7	A"	3331	3331	0.01
8	A"	1214	1214	0.00
9	A"	886	886	2.44

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.029	0.000
Br2	0.837	-0.727	0.000
Cl3	-1.762	0.953	0.000
H4	0.333	1.536	0.893
H5	0.333	1.536	-0.893

	C1	Br2	Cl3	H4	H5
C1		1.9450	1.7636	1.0793	1.0793
Br2	1.9450		3.0944	2.4843	2.4843
Cl3	1.7636	3.0944		2.3504	2.3504
H4	1.0793	2.4843	2.3504		1.7858
H5	1.0793	2.4843	2.3504	1.7858

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	113.014	Br2	C1	H4	106.943
Br2	C1	H5	106.943	Cl3	C1	H4	109.157
Cl3	C1	H5	109.157	H4	C1	H5	111.638

All results from a given calculation for CH₂BrCl (Methane, bromochloro-)

using model chemistry: MP3=FULL/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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All results from a given calculation for CH2BrCl (Methane, bromochloro-)

using model chemistry: MP3=FULL/6-31G**

States and conformations

All results from a given calculation for CH₂BrCl (Methane, bromochloro-)