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	hartrees
Energy at 0K	-997.526007
Energy at 298.15K	-997.528116
HF Energy	-997.295829
Nuclear repulsion energy	184.790783

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3249	3117	1.28
2	A₁	1647	1580	34.43
3	A₁	1217	1168	0.03
4	A₁	721	692	19.61
5	A₁	167	160	0.26
6	A₂	910	873	0.00
7	A₂	422	405	0.00
8	B₁	717	688	55.36
9	B₂	3227	3096	14.17
10	B₂	1328	1274	26.21
11	B₂	861	826	76.53
12	B₂	576	553	6.18

Atom	y (Å)	z (Å)
C1	0.667	0.980
C2	-0.667	0.980
H3	1.207	1.905
H4	-1.207	1.905
Cl5	1.620	-0.458
Cl6	-1.620	-0.458

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3332	1.0707	2.0893	1.7254	2.7010
C2	1.3332		2.0893	1.0707	2.7010	1.7254
H3	1.0707	2.0893		2.4141	2.3984	3.6840
H4	2.0893	1.0707	2.4141		3.6840	2.3984
Cl5	1.7254	2.7010	2.3984	3.6840		3.2392
Cl6	2.7010	1.7254	3.6840	2.3984	3.2392

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.312	C1	C2	Cl6	123.527
C2	C1	H3	120.312	C2	C1	Cl5	123.527
H3	C1	Cl5	116.161	H4	C2	Cl6	116.161

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

using model chemistry: B2PLYP/cc-pVTZ

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	-0.105
2	C	-0.105
3	H	0.170
4	H	0.170
5	Cl	-0.065
6	Cl	-0.065

	x	y	z	Total
	0.000	0.000	1.883	1.883
CHELPG
AIM
ESP

<r²>	148.582
(<r²>)^1/2	12.189