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	hartrees
Energy at 0K	-996.433356
Energy at 298.15K	-996.435470
HF Energy	-995.877831
Nuclear repulsion energy	183.994882

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3279	3116	1.70
2	A₁	1657	1575	31.89
3	A₁	1213	1153	0.00
4	A₁	746	709	19.73
5	A₁	167	159	0.24
6	A₂	890	846	0.00
7	A₂	416	395	0.00
8	B₁	719	683	53.98
9	B₂	3257	3095	13.36
10	B₂	1322	1256	25.26
11	B₂	886	842	69.42
12	B₂	581	552	3.83

Atom	y (Å)	z (Å)
C1	0.673	0.963
C2	-0.673	0.963
H3	1.218	1.910
H4	-1.218	1.910
Cl5	1.655	-0.452
Cl6	-1.655	-0.452

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3462	1.0923	2.1149	1.7226	2.7247
C2	1.3462		2.1149	1.0923	2.7247	1.7226
H3	1.0923	2.1149		2.4362	2.4018	3.7194
H4	2.1149	1.0923	2.4362		3.7194	2.4018
Cl5	1.7226	2.7247	2.4018	3.7194		3.3107
Cl6	2.7247	1.7226	3.7194	2.4018	3.3107

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	119.928	C1	C2	Cl6	124.766
C2	C1	H3	119.928	C2	C1	Cl5	124.766
H3	C1	Cl5	115.305	H4	C2	Cl6	115.305

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

using model chemistry: MP2=FULL/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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