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	hartrees
Energy at 0K	-995.040867
Energy at 298.15K	-995.042918
HF Energy	-995.040867
Nuclear repulsion energy	185.740438

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3168	3121	0.03
2	A₁	1643	1618	44.86
3	A₁	1168	1151	0.28
4	A₁	742	731	20.00
5	A₁	163	161	0.14
6	A₂	851	838	0.00
7	A₂	417	411	0.00
8	B₁	679	669	75.51
9	B₂	3149	3102	20.48
10	B₂	1261	1242	18.48
11	B₂	870	857	94.92
12	B₂	576	567	2.99
1	A₁	3169	3122	0.03
2	A₁	1643	1618	44.87
3	A₁	1168	1151	0.28
4	A₁	741	730	19.99
5	A₁	163	161	0.14
6	A₂	850	838	0.00
7	A₂	417	411	0.00
8	B₁	678	668	75.50
9	B₂	3151	3104	20.51
10	B₂	1260	1242	18.54
11	B₂	870	857	94.99
12	B₂	576	567	2.99

Atom	y (Å)	z (Å)
C1	0.667	0.959
C2	-0.667	0.959
H3	1.224	1.900
H4	-1.224	1.900
Cl5	1.633	-0.450
Cl6	-1.633	-0.450
C1	0.667	0.958
C2	-0.667	0.958
H3	1.224	1.900
H4	-1.224	1.900
Cl5	1.634	-0.450
Cl6	-1.634	-0.450

	C1	C2	H3	H4	Cl5	Cl6	C7	C8	H9	H10	Cl11	Cl12
C1		1.3348	1.0940	2.1129	1.7078	2.6974	0.0002	1.3347	1.0936	2.1125	1.7080	2.6978
C2	1.3348		2.1129	1.0940	2.6974	1.7078	1.3347	0.0002	2.1125	1.0936	2.6978	1.7080
H3	1.0940	2.1129		2.4481	2.3857	3.6996	1.0942	2.1130	0.0004	2.4478	2.3857	3.7000
H4	2.1129	1.0940	2.4481		3.6996	2.3857	2.1130	1.0942	2.4478	0.0004	3.7000	2.3857
Cl5	1.7078	2.6974	2.3857	3.6996		3.2660	1.7076	2.6972	2.3854	3.6992	0.0006	3.2666
Cl6	2.6974	1.7078	3.6996	2.3857	3.2660		2.6972	1.7076	3.6992	2.3854	3.2666	0.0006
C7	0.0002	1.3347	1.0942	2.1130	1.7076	2.6972		1.3347	1.0938	2.1126	1.7079	2.6977
C8	1.3347	0.0002	2.1130	1.0942	2.6972	1.7076	1.3347		2.1126	1.0938	2.6977	1.7079
H9	1.0936	2.1125	0.0004	2.4478	2.3854	3.6992	1.0938	2.1126		2.4476	2.3854	3.6996
H10	2.1125	1.0936	2.4478	0.0004	3.6992	2.3854	2.1126	1.0938	2.4476		3.6996	2.3854
Cl11	1.7080	2.6978	2.3857	3.7000	0.0006	3.2666	1.7079	2.6977	2.3854	3.6996		3.2672
Cl12	2.6978	1.7080	3.7000	2.3857	3.2666	0.0006	2.6977	1.7079	3.6996	2.3854	3.2672

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.587	C1	C2	H4	120.579
C1	C2	Cl6	124.455	C1	C2	Cl6	124.431
C2	C1	H3	120.587	C2	C1	H3	120.579
C2	C1	Cl5	124.455	C2	C1	Cl5	124.431
H3	C1	Cl5	114.981	H3	C1	Cl5	114.966
H4	C2	Cl6	114.966	H4	C2	Cl6	114.981

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

using model chemistry: SVWN/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
1	C	-0.287
2	C	-0.287
3	H	0.217
4	H	0.217
5	Cl	0.070
6	Cl	0.070
1	C	-0.287
2	C	-0.287
3	H	0.217
4	H	0.217
5	Cl	0.070
6	Cl	0.070

<r²>	146.929
(<r²>)^1/2	12.121