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	hartrees
Energy at 0K	-995.185123
Energy at 298.15K	-995.183725
HF Energy	-994.641197
Nuclear repulsion energy	151.850561

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2356	2254	0.00
2	Σ_g	480	459	0.00
3	Σ_u	1008	964	46.79
4	Π_g	337	323	0.00
4	Π_g	337	323	0.00
5	Π_u	181	173	1.16
5	Π_u	181	173	1.16

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.608
C2	0.000	0.000	-0.608
Cl3	0.000	0.000	2.269
Cl4	0.000	0.000	-2.269

	C1	C2	Cl3	Cl4
C1		1.2155	1.6617	2.8772
C2	1.2155		2.8772	1.6617
Cl3	1.6617	2.8772		4.5389
Cl4	2.8772	1.6617	4.5389

All results from a given calculation for C₂Cl₂ (dichloroacetylene)

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

using model chemistry: CCD/cc-pVDZ

States and conformations

All results from a given calculation for C₂Cl₂ (dichloroacetylene)