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	hartrees
Energy at 0K	-997.873747
Energy at 298.15K	-997.875849
Nuclear repulsion energy	185.028879

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3252	3126	0.83
2	A₁	1689	1623	38.19
3	A₁	1188	1142	0.04
4	A₁	739	710	22.82
5	A₁	167	161	0.25
6	A₂	890	855	0.00
7	A₂	421	404	0.00
8	B₁	707	680	54.82
9	B₂	3230	3104	14.49
10	B₂	1292	1242	25.01
11	B₂	869	835	84.78
12	B₂	580	558	4.99

Atom	y (Å)	z (Å)
C1	0.666	0.962
C2	-0.666	0.962
H3	1.220	1.900
H4	-1.220	1.900
Cl5	1.642	-0.451
Cl6	-1.642	-0.451

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3314	1.0891	2.1059	1.7183	2.7066
C2	1.3314		2.1059	1.0891	2.7066	1.7183
H3	1.0891	2.1059		2.4400	2.3888	3.7042
H4	2.1059	1.0891	2.4400		3.7042	2.3888
Cl5	1.7183	2.7066	2.3888	3.7042		3.2847
Cl6	2.7066	1.7183	3.7042	2.3888	3.2847

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.595	C1	C2	Cl6	124.639
C2	C1	H3	120.595	C2	C1	Cl5	124.639
H3	C1	Cl5	114.766	H4	C2	Cl6	114.766

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

using model chemistry: B1B95/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	-0.041
2	C	-0.041
3	H	0.073
4	H	0.073
5	Cl	-0.032
6	Cl	-0.032

	x	y	z	Total
	0.000	0.000	1.848	1.848
CHELPG
AIM
ESP

<r²>	147.516
(<r²>)^1/2	12.146