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	hartrees
Energy at 0K	-1917.130862
Energy at 298.15K	-1917.130867
Nuclear repulsion energy	491.226398

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1616	1562	0.00
2	A_g	444	430	0.00
3	A_g	237	229	0.00
4	A_u	99	95	0.00
5	B_1u	768	743	75.66
6	B_1u	312	301	0.05
7	B_2g	547	528	0.00
8	B_2u	876	847	197.09
9	B_2u	177	171	0.83
10	B_3g	960	928	0.00
11	B_3g	345	333	0.00
12	B_3u	293	283	0.40

Atom	y (Å)	z (Å)
C1	0.000	0.669
C2	0.000	-0.669
Cl3	1.455	1.596
Cl4	-1.455	1.596
Cl5	-1.455	-1.596
Cl6	1.455	-1.596

	C1	C2	Cl3	Cl4	Cl5	Cl6
C1		1.3390	1.7254	1.7254	2.6929	2.6929
C2	1.3390		2.6929	2.6929	1.7254	1.7254
Cl3	1.7254	2.6929		2.9105	4.3203	3.1928
Cl4	1.7254	2.6929	2.9105		3.1928	4.3203
Cl5	2.6929	1.7254	4.3203	3.1928		2.9105
Cl6	2.6929	1.7254	3.1928	4.3203	2.9105

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	122.495	C1	C2	Cl6	122.495
C2	C1	Cl3	122.495	C2	C1	Cl4	122.495
Cl3	C1	Cl4	115.010	Cl5	C2	Cl6	115.010

All results from a given calculation for C₂Cl₄ (Tetrachloroethylene)

using model chemistry: B3LYP/cc-pVTZ

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	ESP
1	C	0.054	0.014
2	C	0.054	0.014
3	Cl	-0.027	-0.007
4	Cl	-0.027	-0.007
5	Cl	-0.027	-0.007
6	Cl	-0.027	-0.007

<r²>	360.232
(<r²>)^1/2	18.980

All results from a given calculation for C2Cl4 (Tetrachloroethylene)

using model chemistry: B3LYP/cc-pVTZ

States and conformations

All results from a given calculation for C₂Cl₄ (Tetrachloroethylene)