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	hartrees
Energy at 0K	-1454.840723
Energy at 298.15K	-1454.842081
Nuclear repulsion energy	319.456132

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3389	3079	14.90
2	A'	1813	1647	8.93
3	A'	1393	1266	11.53
4	A'	1030	936	89.97
5	A'	907	824	107.36
6	A'	682	619	13.45
7	A'	418	380	0.01
8	A'	300	273	0.33
9	A'	188	171	0.98
10	A"	950	863	22.50
11	A"	533	485	3.91
12	A"	229	208	0.83

Atom	x (Å)	y (Å)
C1	-1.021	-0.389
C2	0.000	0.432
H3	-2.021	-0.013
Cl4	-0.899	-2.096
Cl5	-0.260	2.131
Cl6	1.638	-0.050

	C1	C2	H3	Cl4	Cl5	Cl6
C1		1.3103	1.0685	1.7107	2.6328	2.6812
C2	1.3103		2.0695	2.6821	1.7193	1.7075
H3	1.0685	2.0695		2.3663	2.7742	3.6597
Cl4	1.7107	2.6821	2.3663		4.2746	3.2589
Cl5	2.6328	1.7193	2.7742	4.2746		2.8915
Cl6	2.6812	1.7075	3.6597	3.2589	2.8915

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	120.080	C1	C2	Cl6	124.835
C2	C1	H3	120.567	C2	C1	Cl4	124.672
H3	C1	Cl4	114.761	Cl5	C2	Cl6	115.085

All results from a given calculation for CHClCCl₂ (Trichloroethylene)

using model chemistry: HF/6-311+G(3df,2p)

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	-0.223
2	C	0.614
3	H	0.169
4	Cl	-0.188
5	Cl	-0.225
6	Cl	-0.146

	x	y	z	Total
	-0.953	0.270	0.000	0.990
CHELPG
AIM
ESP

	x	y	z
x	9.959	1.089	0.000
y	1.089	12.222	0.000
z	0.000	0.000	6.438

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CHClCCl2 (Trichloroethylene)

using model chemistry: HF/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CHClCCl₂ (Trichloroethylene)