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	hartrees
Energy at 0K	-997.350722
Energy at 298.15K	-997.352740
Nuclear repulsion energy	183.391691

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3158	3130	1.93
2	A₁	1606	1591	41.64
3	A₁	1177	1166	0.01
4	A₁	699	693	22.13
5	A₁	163	162	0.17
6	A₂	848	840	0.00
7	A₂	407	404	0.00
8	B₁	680	674	75.27
9	B₂	3138	3109	14.33
10	B₂	1270	1259	21.49
11	B₂	834	827	104.17
12	B₂	563	558	5.24

Atom	y (Å)	z (Å)
C1	0.669	0.961
C2	-0.669	0.961
H3	1.223	1.899
H4	-1.223	1.899
Cl5	1.669	-0.451
Cl6	-1.669	-0.451

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3372	1.0896	2.1113	1.7303	2.7308
C2	1.3372		2.1113	1.0896	2.7308	1.7303
H3	1.0896	2.1113		2.4459	2.3918	3.7262
H4	2.1113	1.0896	2.4459		3.7262	2.3918
Cl5	1.7303	2.7308	2.3918	3.7262		3.3377
Cl6	2.7308	1.7303	3.7262	2.3918	3.3377

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.581	C1	C2	Cl6	125.317
C2	C1	H3	120.581	C2	C1	Cl5	125.317
H3	C1	Cl5	114.102	H4	C2	Cl6	114.102

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

using model chemistry: PBEPBE/6-311G**

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	-0.182
2	C	-0.182
3	H	0.188
4	H	0.188
5	Cl	-0.006
6	Cl	-0.006

	x	y	z	Total
	0.000	0.000	1.893	1.893
CHELPG
AIM
ESP

<r²>	151.146
(<r²>)^1/2	12.294