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	hartrees
Energy at 0K	-3527.300702
Energy at 298.15K	-3527.304945
HF Energy	-3527.077954
Nuclear repulsion energy	380.604264

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3261	3120	0.09
2	A'	1227	1174	33.44
3	A'	680	650	105.15
4	A'	567	543	9.04
5	A'	308	295	0.40
6	A'	212	203	0.24
7	A"	1258	1204	20.52
8	A"	699	669	120.35
9	A"	209	200	0.15

Atom	x (Å)	y (Å)	z (Å)
C1	-0.692	-0.118	0.000
H2	-1.610	0.461	0.000
Br3	0.836	1.143	0.000
Cl4	-0.692	-1.170	1.532
Cl5	-0.692	-1.170	-1.532

	C1	H2	Br3	Cl4	Cl5
C1		1.0852	1.9811	1.8581	1.8581
H2	1.0852		2.5396	2.4181	2.4181
Br3	1.9811	2.5396		3.1671	3.1671
Cl4	1.8581	2.4181	3.1671		3.0633
Cl5	1.8581	2.4181	3.1671	3.0633

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	108.252	H2	C1	Cl4	107.564
H2	C1	Cl5	107.564	Br3	C1	Cl4	111.123
Br3	C1	Cl5	111.123	Cl4	C1	Cl5	111.039

All results from a given calculation for CHBrCl₂ (Methane, bromodichloro-)

using model chemistry: MP2/6-31G

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 CHBrCl2 (Methane, bromodichloro-)

using model chemistry: MP2/6-31G

States and conformations

All results from a given calculation for CHBrCl₂ (Methane, bromodichloro-)