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	hartrees
Energy at 0K	-997.895482
Energy at 298.15K	-997.897586
Nuclear repulsion energy	185.227809

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3247	3113	3.98
2	A₁	1683	1613	38.00
3	A₁	1224	1174	0.04
4	A₁	732	701	23.54
5	A₁	168	161	0.24
6	A₂	901	864	0.00
7	A₂	422	405	0.00
8	B₁	712	682	77.09
9	B₂	3226	3092	11.77
10	B₂	1329	1274	23.63
11	B₂	872	835	101.94
12	B₂	582	558	4.89

Atom	y (Å)	z (Å)
C1	0.662	0.958
C2	-0.662	0.958
H3	1.215	1.886
H4	-1.215	1.886
Cl5	1.646	-0.449
Cl6	-1.646	-0.449

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3244	1.0807	2.0941	1.7167	2.7032
C2	1.3244		2.0941	1.0807	2.7032	1.7167
H3	1.0807	2.0941		2.4294	2.3750	3.6931
H4	2.0941	1.0807	2.4294		3.6931	2.3750
Cl5	1.7167	2.7032	2.3750	3.6931		3.2924
Cl6	2.7032	1.7167	3.6931	2.3750	3.2924

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.747	C1	C2	Cl6	124.973
C2	C1	H3	120.747	C2	C1	Cl5	124.973
H3	C1	Cl5	114.279	H4	C2	Cl6	114.279

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

using model chemistry: B1B95/6-311G*

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	-0.276
2	C	-0.276
3	H	0.281
4	H	0.281
5	Cl	-0.005
6	Cl	-0.005

	x	y	z	Total
	0.000	0.000	2.010	2.010
CHELPG
AIM
ESP

<r²>	147.938
(<r²>)^1/2	12.163