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	hartrees
Energy at 0K	-3068.886574
Energy at 298.15K	-3068.891850
HF Energy	-3068.410304
Nuclear repulsion energy	217.262247

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3184	3184
2	A'	1493	1493
3	A'	1308	1308
4	A'	766	766
5	A'	610	610
6	A'	228	228
7	A"	3272	3272
8	A"	1180	1180
9	A"	883	883

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.028	0.000
Br2	0.841	-0.732	0.000
Cl3	-1.770	0.963	0.000
H4	0.333	1.536	0.897
H5	0.333	1.536	-0.897

	C1	Br2	Cl3	H4	H5
C1		1.9507	1.7713	1.0834	1.0834
Br2	1.9507		3.1124	2.4911	2.4911
Cl3	1.7713	3.1124		2.3575	2.3575
H4	1.0834	2.4911	2.3575		1.7944
H5	1.0834	2.4911	2.3575	1.7944

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	Cl3	113.402	Br2	C1	H4	106.873
Br2	C1	H5	106.873	Cl3	C1	H4	108.955
Cl3	C1	H5	108.955	H4	C1	H5	111.813

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

using model chemistry: QCISD(T)=FULL/6-31+G**

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)=FULL/6-31+G**

States and conformations

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