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	hartrees
Energy at 0K	-997.322300
Energy at 298.15K	-997.324300
Nuclear repulsion energy	183.158414

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3158	3140	1.18
2	A₁	1612	1603	41.10
3	A₁	1152	1145	0.05
4	A₁	709	705	21.40
5	A₁	159	158	0.18
6	A₂	831	826	0.00
7	A₂	405	403	0.00
8	B₁	674	670	54.14
9	B₂	3137	3119	13.00
10	B₂	1247	1240	23.36
11	B₂	836	832	85.82
12	B₂	563	559	5.33

Atom	y (Å)	z (Å)
C1	0.672	0.965
C2	-0.672	0.965
H3	1.229	1.913
H4	-1.229	1.913
Cl5	1.666	-0.453
Cl6	-1.666	-0.453

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3449	1.0990	2.1243	1.7315	2.7348
C2	1.3449		2.1243	1.0990	2.7348	1.7315
H3	1.0990	2.1243		2.4573	2.4060	3.7385
H4	2.1243	1.0990	2.4573		3.7385	2.4060
Cl5	1.7315	2.7348	2.4060	3.7385		3.3320
Cl6	2.7348	1.7315	3.7385	2.4060	3.3320

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.405	C1	C2	Cl6	125.017
C2	C1	H3	120.405	C2	C1	Cl5	125.017
H3	C1	Cl5	114.578	H4	C2	Cl6	114.578

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

using model chemistry: PBEPBE/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	-0.045
2	C	-0.045
3	H	0.069
4	H	0.069
5	Cl	-0.024
6	Cl	-0.024

	x	y	z	Total
	0.000	0.000	1.715	1.715
CHELPG
AIM
ESP

<r²>	150.601
(<r²>)^1/2	12.272