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	hartrees
Energy at 0K	-3530.791543
Energy at 298.15K	-3530.795942
HF Energy	-3529.941819
Nuclear repulsion energy	394.546129

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3186	3106
2	A'	1203	1173
3	A'	747	728
4	A'	614	598
5	A'	330	322
6	A'	223	217
7	A"	1238	1207
8	A"	786	767
9	A"	216	210

Atom	x (Å)	y (Å)	z (Å)
C1	-0.671	-0.132	0.000
H2	-1.577	0.460	0.000
Br3	0.812	1.110	0.000
Cl4	-0.671	-1.133	1.462
Cl5	-0.671	-1.133	-1.462

	C1	H2	Br3	Cl4	Cl5
C1		1.0815	1.9349	1.7713	1.7713
H2	1.0815		2.4760	2.3433	2.3433
Br3	1.9349	2.4760		3.0605	3.0605
Cl4	1.7713	2.3433	3.0605		2.9230
Cl5	1.7713	2.3433	3.0605	2.9230

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	106.912	H2	C1	Cl4	108.002
H2	C1	Cl5	108.002	Br3	C1	Cl4	111.261
Br3	C1	Cl5	111.261	Cl4	C1	Cl5	111.197

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

using model chemistry: CCSD(T)/cc-pVTZ

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)/cc-pVTZ

States and conformations

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