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	hartrees
Energy at 0K	-997.723708
Energy at 298.15K	-997.725847
HF Energy	-997.723708
Nuclear repulsion energy	184.264499

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3276	3120	1.06
2	A₁	1702	1621	39.62
3	A₁	1244	1185	0.03
4	A₁	730	696	23.18
5	A₁	170	162	0.28
6	A₂	930	886	0.00
7	A₂	428	408	0.00
8	B₁	728	693	70.89
9	B₂	3255	3101	15.16
10	B₂	1344	1280	27.71
11	B₂	874	832	93.44
12	B₂	583	555	6.28

Atom	y (Å)	z (Å)
C1	0.666	0.975
C2	-0.666	0.975
H3	1.206	1.907
H4	-1.206	1.907
Cl5	1.632	-0.456
Cl6	-1.632	-0.456

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3316	1.0770	2.0906	1.7273	2.7074
C2	1.3316		2.0906	1.0770	2.7074	1.7273
H3	1.0770	2.0906		2.4113	2.4018	3.6931
H4	2.0906	1.0770	2.4113		3.6931	2.4018
Cl5	1.7273	2.7074	2.4018	3.6931		3.2640
Cl6	2.7074	1.7273	3.6931	2.4018	3.2640

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.083	C1	C2	Cl6	124.013
C2	C1	H3	120.083	C2	C1	Cl5	124.013
H3	C1	Cl5	115.904	H4	C2	Cl6	115.904

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

using model chemistry: wB97X-D/cc-pVDZ

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	-0.262
2	C	-0.262
3	H	0.210
4	H	0.210
5	Cl	0.052
6	Cl	0.052

	x	y	z	Total
	0.000	0.000	2.104	2.104
CHELPG
AIM
ESP

<r²>	149.525
(<r²>)^1/2	12.228