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	hartrees
Energy at 0K	-3071.609900
Energy at 298.15K	-3071.615209
HF Energy	-3071.020269
Nuclear repulsion energy	219.715275

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3160	3000	4.01
2	A'	1469	1395	0.00
3	A'	1267	1203	50.38
4	A'	780	741	87.41
5	A'	646	614	19.19
6	A'	233	221	0.23
7	A"	3244	3080	0.55
8	A"	1169	1110	0.01
9	A"	870	826	2.49

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.017	0.000
Br2	0.837	-0.712	0.000
Cl3	-1.762	0.927	0.000
H4	0.320	1.533	0.895
H5	0.320	1.533	-0.895

	C1	Br2	Cl3	H4	H5
C1		1.9212	1.7640	1.0817	1.0817
Br2	1.9212		3.0733	2.4723	2.4723
Cl3	1.7640	3.0733		2.3453	2.3453
H4	1.0817	2.4723	2.3453		1.7899
H5	1.0817	2.4723	2.3453	1.7899

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	112.946	Br2	C1	H4	107.520
Br2	C1	H5	107.520	Cl3	C1	H4	108.625
Cl3	C1	H5	108.625	H4	C1	H5	111.649

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

using model chemistry: MP2/cc-pVTZ

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/cc-pVTZ

States and conformations

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