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	hartrees
Energy at 0K	-995.434126
Energy at 298.15K	-995.432695
HF Energy	-994.696658
Nuclear repulsion energy	152.932004

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ_g	2289	2231
2	Σ_g	472	460
3	Σ_u	993	968
4	Π_g	333	325
4	Π_g	333	325
5	Π_u	175	170
5	Π_u	175	170

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.604
C2	0.000	0.000	-0.604
Cl3	0.000	0.000	2.253
Cl4	0.000	0.000	-2.253

	C1	C2	Cl3	Cl4
C1		1.2087	1.6490	2.8577
C2	1.2087		2.8577	1.6490
Cl3	1.6490	2.8577		4.5066
Cl4	2.8577	1.6490	4.5066

All results from a given calculation for C₂Cl₂ (dichloroacetylene)

using model chemistry: CCSD(T)/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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All results from a given calculation for C2Cl2 (dichloroacetylene)

using model chemistry: CCSD(T)/cc-pVTZ

States and conformations

All results from a given calculation for C₂Cl₂ (dichloroacetylene)