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	hartrees
Energy at 0K	-1916.960572
Energy at 298.15K	-1916.960453
HF Energy	-1916.960572
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1574	1543	0.00
2	A_g	438	429	0.00
3	A_g	239	234	0.00
4	A_u	92	90	0.00
5	B_1u	752	737	82.15
6	B_1u	313	307	0.08
7	B_2g	502	492	0.00
8	B_2u	855	838	250.50
9	B_2u	176	173	0.96
10	B_3g	938	919	0.00
11	B_3g	337	330	0.00
12	B_3u	287	281	0.55

Atom	y (Å)	z (Å)
C1	0.000	0.679
C2	0.000	-0.679
Cl3	1.462	1.604
Cl4	-1.462	1.604
Cl5	-1.462	-1.604
Cl6	1.462	-1.604

	C1	C2	Cl3	Cl4	Cl5	Cl6
C1		1.3572	1.7303	1.7303	2.7107	2.7107
C2	1.3572		2.7107	2.7107	1.7303	1.7303
Cl3	1.7303	2.7107		2.9241	4.3406	3.2079
Cl4	1.7303	2.7107	2.9241		3.2079	4.3406
Cl5	2.7107	1.7303	4.3406	3.2079		2.9241
Cl6	2.7107	1.7303	3.2079	4.3406	2.9241

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	120.293	C1	C2	Cl6	120.293
C2	C1	Cl3	120.293	C2	C1	Cl4	120.293
Cl3	C1	Cl4	119.414	Cl5	C2	Cl6	119.414

All results from a given calculation for C₂Cl₄ (Tetrachloroethylene)

using model chemistry: B97D3/6-31G*

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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Number	Element	Mulliken
1	C	-0.187
2	C	-0.187
3	Cl	0.094
4	Cl	0.094
5	Cl	0.094
6	Cl	0.094

<r²>	362.865
(<r²>)^1/2	19.049

All results from a given calculation for C2Cl4 (Tetrachloroethylene)

using model chemistry: B97D3/6-31G*

States and conformations

All results from a given calculation for C₂Cl₄ (Tetrachloroethylene)