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	hartrees
Energy at 0K	-995.164751
Energy at 298.15K	-995.163210
HF Energy	-994.639412
Nuclear repulsion energy	151.979041

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2255	2148	0.00
2	Σ_g	482	459	0.00
3	Σ_u	1020	972	56.76
4	Π_g	280	267	0.00
4	Π_g	280	267	0.00
5	Π_u	178	169	1.43
5	Π_u	178	169	1.43

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.614
C2	0.000	0.000	-0.614
Cl3	0.000	0.000	2.268
Cl4	0.000	0.000	-2.268

	C1	C2	Cl3	Cl4
C1		1.2282	1.6535	2.8817
C2	1.2282		2.8817	1.6535
Cl3	1.6535	2.8817		4.5352
Cl4	2.8817	1.6535	4.5352

Number	Element	Mulliken
1	C	0.012
2	C	0.012
3	Cl	-0.012
4	Cl	-0.012

All results from a given calculation for C₂Cl₂ (dichloroacetylene)

using model chemistry: MP2/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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<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2Cl2 (dichloroacetylene)

using model chemistry: MP2/cc-pVDZ

States and conformations

All results from a given calculation for C₂Cl₂ (dichloroacetylene)