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	hartrees
Energy at 0K	-5643.285453
Energy at 298.15K	-5643.292535
HF Energy	-5642.698494
Nuclear repulsion energy	570.440835

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3186	3119
2	A'	1213	1187
3	A'	760	744
4	A'	567	555
5	A'	280	274
6	A'	169	165
7	A"	1173	1148
8	A"	675	660
9	A"	202	198

Atom	x (Å)	y (Å)	z (Å)
C1	-0.235	0.602	0.000
H2	-1.174	1.169	0.000
Cl3	1.118	1.762	0.000
Br4	-0.235	-0.496	1.614
Br5	-0.235	-0.496	-1.614

	C1	H2	Cl3	Br4	Br5
C1		1.0975	1.7816	1.9520	1.9520
H2	1.0975		2.3667	2.5023	2.5023
Cl3	1.7816	2.3667		3.0873	3.0873
Br4	1.9520	2.5023	3.0873		3.2281
Br5	1.9520	2.5023	3.0873	3.2281

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Cl3	108.215	H2	C1	Br4	106.916
H2	C1	Br5	106.916	Cl3	C1	Br4	111.482
Cl3	C1	Br5	111.482	Br4	C1	Br5	111.557

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

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

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: CCSD(T)/cc-pVDZ

States and conformations

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