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	hartrees
Energy at 0K	-997.282790
Energy at 298.15K	-997.284800
Nuclear repulsion energy	183.068593

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3170	3134	1.25
2	A₁	1607	1589	46.46
3	A₁	1183	1170	0.11
4	A₁	704	696	21.44
5	A₁	161	159	0.17
6	A₂	843	833	0.00
7	A₂	408	403	0.00
8	B₁	681	673	71.63
9	B₂	3150	3114	14.71
10	B₂	1276	1261	25.19
11	B₂	841	832	97.42
12	B₂	566	559	5.42

Atom	y (Å)	z (Å)
C1	0.672	0.961
C2	-0.672	0.961
H3	1.223	1.904
H4	-1.223	1.904
Cl5	1.673	-0.451
Cl6	-1.673	-0.451

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3437	1.0923	2.1166	1.7305	2.7368
C2	1.3437		2.1166	1.0923	2.7368	1.7305
H3	1.0923	2.1166		2.4461	2.3972	3.7324
H4	2.1166	1.0923	2.4461		3.7324	2.3972
Cl5	1.7305	2.7368	2.3972	3.7324		3.3458
Cl6	2.7368	1.7305	3.7324	2.3972	3.3458

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.305	C1	C2	Cl6	125.344
C2	C1	H3	120.305	C2	C1	Cl5	125.344
H3	C1	Cl5	114.351	H4	C2	Cl6	114.351

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

using model chemistry: PBEPBE/6-31+G**

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	-0.275
2	C	-0.275
3	H	0.205
4	H	0.205
5	Cl	0.070
6	Cl	0.070

	x	y	z	Total
	0.000	0.000	1.879	1.879
CHELPG
AIM
ESP

<r²>	151.610
(<r²>)^1/2	12.313