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	hartrees
Energy at 0K	-3071.353085
Energy at 298.15K	-3071.358366
HF Energy	-3070.905152
Nuclear repulsion energy	217.016414

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3121	3005
2	A'	1477	1422
3	A'	1305	1257
4	A'	760	732
5	A'	615	592
6	A'	232	223
7	A"	3200	3081
8	A"	1192	1148
9	A"	873	840

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.027	0.000
Br2	0.843	-0.730	0.000
Cl3	-1.775	0.959	0.000
H4	0.328	1.544	0.900
H5	0.328	1.544	-0.900

	C1	Br2	Cl3	H4	H5
C1		1.9490	1.7763	1.0887	1.0887
Br2	1.9490		3.1160	2.4994	2.4994
Cl3	1.7763	3.1160		2.3613	2.3613
H4	1.0887	2.4994	2.3613		1.8003
H5	1.0887	2.4994	2.3613	1.8003

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	113.454	Br2	C1	H4	107.317
Br2	C1	H5	107.317	Cl3	C1	H4	108.624
Cl3	C1	H5	108.624	H4	C1	H5	111.546

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

using model chemistry: QCISD(T)/6-311G*

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: QCISD(T)/6-311G*

States and conformations

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