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	hartrees
Energy at 0K	-995.131993
Energy at 298.15K	-995.130174
HF Energy	-994.593778
Nuclear repulsion energy	152.690708

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2371	2239	0.00
2	Σ_g	480	453	0.00
3	Σ_u	1007	951	40.74
4	Π_g	195	184	0.00
4	Π_g	195	184	0.00
5	Π_u	170	161	0.67
5	Π_u	170	161	0.67

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.603
C2	0.000	0.000	-0.603
Cl3	0.000	0.000	2.257
Cl4	0.000	0.000	-2.257

	C1	C2	Cl3	Cl4
C1		1.2070	1.6535	2.8605
C2	1.2070		2.8605	1.6535
Cl3	1.6535	2.8605		4.5139
Cl4	2.8605	1.6535	4.5139

All results from a given calculation for C₂Cl₂ (dichloroacetylene)

using model chemistry: CCSD/6-31G*

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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All results from a given calculation for C2Cl2 (dichloroacetylene)

using model chemistry: CCSD/6-31G*

States and conformations

All results from a given calculation for C₂Cl₂ (dichloroacetylene)