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	hartrees
Energy at 0K	-997.362902
Energy at 298.15K	-997.365003
HF Energy	-997.191437
Nuclear repulsion energy	183.932869

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3282	3115	2.31
2	A₁	1677	1591	33.00
3	A₁	1250	1187	0.01
4	A₁	728	691	22.54
5	A₁	169	161	0.27
6	A₂	906	860	0.00
7	A₂	421	400	0.00
8	B₁	725	688	57.68
9	B₂	3262	3096	12.67
10	B₂	1357	1288	27.02
11	B₂	878	833	81.71
12	B₂	582	553	5.61

Atom	y (Å)	z (Å)
C1	0.669	0.975
C2	-0.669	0.975
H3	1.210	1.906
H4	-1.210	1.906
Cl5	1.639	-0.456
Cl6	-1.639	-0.456

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3381	1.0769	2.0971	1.7291	2.7158
C2	1.3381		2.0971	1.0769	2.7158	1.7291
H3	1.0769	2.0971		2.4198	2.4013	3.7011
H4	2.0971	1.0769	2.4198		3.7011	2.4013
Cl5	1.7291	2.7158	2.4013	3.7011		3.2778
Cl6	2.7158	1.7291	3.7011	2.4013	3.2778

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.149	C1	C2	Cl6	124.119
C2	C1	H3	120.149	C2	C1	Cl5	124.119
H3	C1	Cl5	115.732	H4	C2	Cl6	115.732

All results from a given calculation for CHClCHCl (Ethene, 1,2-dichloro-, (Z)-)

using model chemistry: B2PLYP/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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Number	Element	Mulliken
1	C	-0.231
2	C	-0.231
3	H	0.213
4	H	0.213
5	Cl	0.019
6	Cl	0.019

	x	y	z	Total
	0.000	0.000	2.068	2.068
CHELPG
AIM
ESP

<r²>	150.002
(<r²>)^1/2	12.248