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	hartrees
Energy at 0K	-997.787356
Energy at 298.15K	-997.789431
Nuclear repulsion energy	183.257312

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3241	3125	1.30
2	A₁	1657	1598	43.62
3	A₁	1224	1181	0.01
4	A₁	707	682	23.11
5	A₁	167	161	0.23
6	A₂	899	867	0.00
7	A₂	419	404	0.00
8	B₁	712	687	68.39
9	B₂	3221	3106	14.98
10	B₂	1323	1276	29.79
11	B₂	852	821	95.05
12	B₂	573	552	7.20

Atom	y (Å)	z (Å)
C1	0.667	0.961
C2	-0.667	0.961
H3	1.215	1.896
H4	-1.215	1.896
Cl5	1.672	-0.451
Cl6	-1.672	-0.451

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3330	1.0837	2.1010	1.7336	2.7321
C2	1.3330		2.1010	1.0837	2.7321	1.7336
H3	1.0837	2.1010		2.4304	2.3906	3.7208
H4	2.1010	1.0837	2.4304		3.7208	2.3906
Cl5	1.7336	2.7321	2.3906	3.7208		3.3449
Cl6	2.7321	1.7336	3.7208	2.3906	3.3449

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.418	C1	C2	Cl6	125.469
C2	C1	H3	120.418	C2	C1	Cl5	125.469
H3	C1	Cl5	114.113	H4	C2	Cl6	114.113

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

using model chemistry: B3LYP/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	ESP
1	C	-0.222	-0.131
2	C	-0.222	-0.131
3	H	0.188	0.174
4	H	0.188	0.174
5	Cl	0.035	-0.043
6	Cl	0.035	-0.043

<r²>	151.450
(<r²>)^1/2	12.306