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	hartrees
Energy at 0K	-5643.215162
Energy at 298.15K	-5643.222319
HF Energy	-5642.677699
Nuclear repulsion energy	575.403116

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3218	3058	0.19
2	A'	1268	1205	29.55
3	A'	792	753	118.52
4	A'	585	556	4.96
5	A'	291	276	0.05
6	A'	173	165	0.00
7	A"	1196	1137	47.30
8	A"	700	665	101.57
9	A"	211	200	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	-0.229	0.595	0.000
H2	-1.164	1.146	0.000
Cl3	1.094	1.755	0.000
Br4	-0.229	-0.494	1.601
Br5	-0.229	-0.494	-1.601

	C1	H2	Cl3	Br4	Br5
C1		1.0847	1.7605	1.9356	1.9356
H2	1.0847		2.3388	2.4745	2.4745
Cl3	1.7605	2.3388		3.0615	3.0615
Br4	1.9356	2.4745	3.0615		3.2014
Br5	1.9356	2.4745	3.0615	3.2014

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Cl3	108.217	H2	C1	Br4	106.599
H2	C1	Br5	106.599	Cl3	C1	Br4	111.758
Cl3	C1	Br5	111.758	Br4	C1	Br5	111.577

All results from a given calculation for CHClBr₂ (Methane, dibromochloro-)

using model chemistry: MP2/6-311G**

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 CHClBr2 (Methane, dibromochloro-)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for CHClBr₂ (Methane, dibromochloro-)