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	hartrees
Energy at 0K	-3530.512645
Energy at 298.15K
HF Energy	-3529.861007
Nuclear repulsion energy	394.012462

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3237	3068	0.28	66.65	0.24	0.39
2	A'	1221	1157	50.76	4.93	0.65	0.79
3	A'	756	716	117.84	5.60	0.71	0.83
4	A'	620	588	18.17	7.91	0.07	0.13
5	A'	339	321	0.26	7.06	0.29	0.45
6	A'	227	215	0.01	5.48	0.62	0.76
7	A"	1277	1211	30.61	4.79	0.75	0.86
8	A"	802	760	131.03	3.77	0.75	0.86
9	A"	220	208	0.05	4.66	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.669	-0.141	0.000
H2	-1.571	0.454	0.000
Br3	0.809	1.116	0.000
Cl4	-0.669	-1.137	1.464
Cl5	-0.669	-1.137	-1.464

	C1	H2	Br3	Cl4	Cl5
C1		1.0809	1.9400	1.7702	1.7702
H2	1.0809		2.4710	2.3423	2.3423
Br3	1.9400	2.4710		3.0660	3.0660
Cl4	1.7702	2.3423	3.0660		2.9270
Cl5	1.7702	2.3423	3.0660	2.9270

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	106.254	H2	C1	Cl4	108.028
H2	C1	Cl5	108.028	Br3	C1	Cl4	111.372
Br3	C1	Cl5	111.372	Cl4	C1	Cl5	111.531

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

using model chemistry: MP2/TZVP

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: MP2/TZVP

States and conformations

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