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	hartrees
Energy at 0K	-3068.843564
Energy at 298.15K	-3068.848875
HF Energy	-3068.410481
Nuclear repulsion energy	218.492878

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3211	3015	4.17
2	A'	1504	1412	0.65
3	A'	1324	1244	73.63
4	A'	792	744	89.76
5	A'	629	591	25.89
6	A'	234	220	0.26
7	A"	3302	3102	0.72
8	A"	1198	1125	0.01
9	A"	896	842	2.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.022	0.000
Br2	0.836	-0.728	0.000
Cl3	-1.760	0.958	0.000
H4	0.334	1.530	0.895
H5	0.334	1.530	-0.895

	C1	Br2	Cl3	H4	H5
C1		1.9386	1.7608	1.0822	1.0822
Br2	1.9386		3.0944	2.4796	2.4796
Cl3	1.7608	3.0944		2.3478	2.3478
H4	1.0822	2.4796	2.3478		1.7907
H5	1.0822	2.4796	2.3478	1.7907

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	113.446	Br2	C1	H4	106.886
Br2	C1	H5	106.886	Cl3	C1	H4	108.994
Cl3	C1	H5	108.994	H4	C1	H5	111.658

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

using model chemistry: MP2=FULL/6-31+G**

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: MP2=FULL/6-31+G**

States and conformations

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