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	hartrees
Energy at 0K	-1916.987315
Energy at 298.15K	-1916.987396
Nuclear repulsion energy	495.061821

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1658	1583	0.00
2	A_g	466	445	0.00
3	A_g	239	228	0.00
4	A_u	101	97	0.00
5	B_1u	805	768	73.47
6	B_1u	317	303	0.01
7	B_2g	551	526	0.00
8	B_2u	941	898	197.17
9	B_2u	177	169	0.85
10	B_3g	1013	967	0.00
11	B_3g	355	339	0.00
12	B_3u	299	285	0.13

Atom	y (Å)	z (Å)
C1	0.000	0.671
C2	0.000	-0.671
Cl3	1.445	1.583
Cl4	-1.445	1.583
Cl5	-1.445	-1.583
Cl6	1.445	-1.583

	C1	C2	Cl3	Cl4	Cl5	Cl6
C1		1.3416	1.7085	1.7085	2.6770	2.6770
C2	1.3416		2.6770	2.6770	1.7085	1.7085
Cl3	1.7085	2.6770		2.8894	4.2861	3.1657
Cl4	1.7085	2.6770	2.8894		3.1657	4.2861
Cl5	2.6770	1.7085	4.2861	3.1657		2.8894
Cl6	2.6770	1.7085	3.1657	4.2861	2.8894

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	122.264	C1	C2	Cl6	122.264
C2	C1	Cl3	122.264	C2	C1	Cl4	122.264
Cl3	C1	Cl4	115.473	Cl5	C2	Cl6	115.473

All results from a given calculation for C₂Cl₄ (Tetrachloroethylene)

using model chemistry: mPW1PW91/6-31G(2df,p)

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	0.068
2	C	0.068
3	Cl	-0.034
4	Cl	-0.034
5	Cl	-0.034
6	Cl	-0.034

<r²>	354.728
(<r²>)^1/2	18.834

All results from a given calculation for C2Cl4 (Tetrachloroethylene)

using model chemistry: mPW1PW91/6-31G(2df,p)

States and conformations

All results from a given calculation for C₂Cl₄ (Tetrachloroethylene)