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	hartrees
Energy at 0K	-991.240804
Energy at 298.15K	-991.243116
Nuclear repulsion energy	185.144552

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3429	3095	0.54
2	A₁	1822	1645	22.58
3	A₁	1367	1234	0.00
4	A₁	736	664	24.37
5	A₁	189	170	0.38
6	A₂	1125	1015	0.00
7	A₂	470	424	0.00
8	B₁	842	760	84.60
9	B₂	3403	3071	14.59
10	B₂	1481	1337	26.98
11	B₂	900	813	77.33
12	B₂	621	561	9.84

Atom	y (Å)	z (Å)
C1	0.654	0.962
C2	-0.654	0.962
H3	1.200	1.880
H4	-1.200	1.880
Cl5	1.648	-0.450
Cl6	-1.648	-0.450

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3087	1.0682	2.0695	1.7269	2.7009
C2	1.3087		2.0695	1.0682	2.7009	1.7269
H3	1.0682	2.0695		2.4007	2.3733	3.6802
H4	2.0695	1.0682	2.4007		3.6802	2.3733
Cl5	1.7269	2.7009	2.3733	3.6802		3.2956
Cl6	2.7009	1.7269	3.6802	2.3733	3.2956

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.740	C1	C2	Cl6	125.119
C2	C1	H3	120.740	C2	C1	Cl5	125.119
H3	C1	Cl5	114.141	H4	C2	Cl6	114.141

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

using model chemistry: HF/3-21G*

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	CHELPG
1	C	-0.326	-0.092
2	C	-0.326	-0.092
3	H	0.294	0.168
4	H	0.294	0.168
5	Cl	0.032	-0.076
6	Cl	0.032	-0.076

<r²>	148.420
(<r²>)^1/2	12.183