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	hartrees
Energy at 0K	-5217.627550
Energy at 298.15K	-5217.635250
HF Energy	-5217.012231
Nuclear repulsion energy	436.722564

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3279	3097	0.00
2	A₁	1623	1533	20.50
3	A₁	1194	1128	1.00
4	A₁	639	604	6.67
5	A₁	117	110	0.04
6	A₂	906	856	0.00
7	A₂	389	368	0.00
8	B₁	707	668	49.35
9	B₂	3258	3077	18.21
10	B₂	1301	1229	30.75
11	B₂	809	764	43.44
12	B₂	490	462	0.91

Atom	y (Å)	z (Å)
C1	0.668	1.248
C2	-0.668	1.248
Br3	1.708	-0.276
Br4	-1.708	-0.276
H5	1.213	2.183
H6	-1.213	2.183

	C1	C2	Br3	Br4	H5	H6
C1		1.3360	1.8456	2.8232	1.0820	2.1007
C2	1.3360		2.8232	1.8456	2.1007	1.0820
Br3	1.8456	2.8232		3.4165	2.5083	3.8187
Br4	2.8232	1.8456	3.4165		3.8187	2.5083
H5	1.0820	2.1007	2.5083	3.8187		2.4268
H6	2.1007	1.0820	3.8187	2.5083	2.4268

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	124.307	C1	C2	H6	120.270
C2	C1	Br3	124.307	C2	C1	H5	120.270
Br3	C1	H5	115.423	Br4	C2	H6	115.423

All results from a given calculation for CHBrCHBr (Ethene, 1,2-dibromo-, (Z)-)

using model chemistry: MP2/6-31G(2df,p)

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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