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	hartrees
Energy at 0K	-3071.751495
Energy at 298.15K	-3071.756816
HF Energy	-3070.905483
Nuclear repulsion energy	218.158266

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3184	3184	6.78
2	A'	1500	1500	0.30
3	A'	1332	1332	60.10
4	A'	790	790	88.13
5	A'	637	637	19.83
6	A'	238	238	0.18
7	A"	3263	3263	0.02
8	A"	1217	1217	0.07
9	A"	887	887	5.58

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.021	0.000
Br2	0.840	-0.725	0.000
Cl3	-1.767	0.952	0.000
H4	0.326	1.537	0.895
H5	0.326	1.537	-0.895

	C1	Br2	Cl3	H4	H5
C1		1.9376	1.7682	1.0838	1.0838
Br2	1.9376		3.0998	2.4869	2.4869
Cl3	1.7682	3.0998		2.3506	2.3506
H4	1.0838	2.4869	2.3506		1.7902
H5	1.0838	2.4869	2.3506	1.7902

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	113.461	Br2	C1	H4	107.402
Br2	C1	H5	107.402	Cl3	C1	H4	108.626
Cl3	C1	H5	108.626	H4	C1	H5	111.358

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

using model chemistry: MP3=FULL/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: MP3=FULL/6-311G*

States and conformations

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