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	hartrees
Energy at 0K	-995.848371
Energy at 298.15K	-995.850655
Nuclear repulsion energy	185.234180

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3401	3080	2.37
2	A₁	1827	1655	30.48
3	A₁	1316	1192	0.21
4	A₁	762	690	25.28
5	A₁	181	164	0.49
6	A₂	1051	952	0.00
7	A₂	460	417	0.00
8	B₁	808	732	48.31
9	B₂	3377	3058	15.45
10	B₂	1432	1297	37.65
11	B₂	919	832	85.28
12	B₂	615	556	8.18

Atom	y (Å)	z (Å)
C1	0.655	0.952
C2	-0.655	0.952
H3	1.197	1.876
H4	-1.197	1.876
Cl5	1.655	-0.446
Cl6	-1.655	-0.446

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3100	1.0714	2.0698	1.7191	2.7002
C2	1.3100		2.0698	1.0714	2.7002	1.7191
H3	1.0714	2.0698		2.3940	2.3673	3.6780
H4	2.0698	1.0714	2.3940		3.6780	2.3673
Cl5	1.7191	2.7002	2.3673	3.6780		3.3097
Cl6	2.7002	1.7191	3.6780	2.3673	3.3097

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.389	C1	C2	Cl6	125.566
C2	C1	H3	120.389	C2	C1	Cl5	125.566
H3	C1	Cl5	114.045	H4	C2	Cl6	114.045

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

using model chemistry: HF/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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Number	Element	Mulliken
1	C	-0.113
2	C	-0.113
3	H	0.200
4	H	0.200
5	Cl	-0.087
6	Cl	-0.087

	x	y	z	Total
	0.000	0.000	2.252	2.252
CHELPG
AIM
ESP

<r²>	148.453
(<r²>)^1/2	12.184