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	hartrees
Energy at 0K	-3527.846672
Energy at 298.15K
HF Energy	-3527.277856
Nuclear repulsion energy	392.596316

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3239	3072
2	A'	1228	1165
3	A'	748	709
4	A'	606	575
5	A'	338	321
6	A'	228	216
7	A"	1295	1228
8	A"	809	767
9	A"	222	211

Atom	x (Å)	y (Å)	z (Å)
C1	-0.683	-0.144	0.000
H2	-1.576	0.469	0.000
Br3	0.825	1.112	0.000
Cl4	-0.683	-1.133	1.466
Cl5	-0.683	-1.133	-1.466

	C1	H2	Br3	Cl4	Cl5
C1		1.0831	1.9621	1.7685	1.7685
H2	1.0831		2.4858	2.3479	2.3479
Br3	1.9621	2.4858		3.0761	3.0761
Cl4	1.7685	2.3479	3.0761		2.9317
Cl5	1.7685	2.3479	3.0761	2.9317

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	105.785	H2	C1	Cl4	108.440
H2	C1	Cl5	108.440	Br3	C1	Cl4	110.978
Br3	C1	Cl5	110.978	Cl4	C1	Cl5	111.962

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

using model chemistry: CCSD(T)/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: CCSD(T)/6-31G**

States and conformations

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