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	hartrees
Energy at 0K	-994.775536
Energy at 298.15K	-994.773818
HF Energy	-994.486663
Nuclear repulsion energy	146.477078

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2198	2122	0.00
2	Σ_g	409	395	0.00
3	Σ_u	868	838	17.80
4	Π_g	294	284	0.00
4	Π_g	294	284	0.00
5	Π_u	146	141	1.34
5	Π_u	146	141	1.34

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.618
C2	0.000	0.000	-0.618
Cl3	0.000	0.000	2.353
Cl4	0.000	0.000	-2.353

	C1	C2	Cl3	Cl4
C1		1.2363	1.7347	2.9710
C2	1.2363		2.9710	1.7347
Cl3	1.7347	2.9710		4.7056
Cl4	2.9710	1.7347	4.7056

Number	Element	Mulliken
1	C	-0.054
2	C	-0.054
3	Cl	0.054
4	Cl	0.054

All results from a given calculation for C₂Cl₂ (dichloroacetylene)

using model chemistry: MP2/SDD

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/SDD

States and conformations

All results from a given calculation for C₂Cl₂ (dichloroacetylene)