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	hartrees
Energy at 0K	-1454.741880
Energy at 298.15K	-1454.743216
Nuclear repulsion energy	318.739675

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3406	3084	15.06
2	A'	1831	1658	8.39
3	A'	1387	1256	12.28
4	A'	1026	929	96.36
5	A'	906	820	110.55
6	A'	680	616	14.94
7	A'	417	377	0.01
8	A'	297	269	0.43
9	A'	186	169	1.13
10	A"	949	859	21.32
11	A"	530	479	2.87
12	A"	229	207	1.33

Atom	x (Å)	y (Å)
C1	-1.025	-0.388
C2	0.000	0.432
H3	-2.026	-0.012
Cl4	-0.901	-2.099
Cl5	-0.261	2.136
Cl6	1.642	-0.051

	C1	C2	H3	Cl4	Cl5	Cl6
C1		1.3123	1.0701	1.7151	2.6371	2.6882
C2	1.3123		2.0745	2.6861	1.7241	1.7119
H3	1.0701	2.0745		2.3710	2.7805	3.6691
Cl4	1.7151	2.6861	2.3710		4.2828	3.2650
Cl5	2.6371	1.7241	2.7805	4.2828		2.8994
Cl6	2.6882	1.7119	3.6691	3.2650	2.8994

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	119.965	C1	C2	Cl6	124.943
C2	C1	H3	120.753	C2	C1	Cl4	124.530
H3	C1	Cl4	114.717	Cl5	C2	Cl6	115.092

All results from a given calculation for CHClCCl₂ (Trichloroethylene)

using model chemistry: HF/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	-0.142
2	C	0.086
3	H	0.218
4	Cl	-0.067
5	Cl	-0.058
6	Cl	-0.037

	x	y	z	Total
	-1.016	0.299	0.000	1.060
CHELPG
AIM
ESP

	x	y	z
x	8.681	1.023	0.000
y	1.023	10.995	0.000
z	0.000	0.000	4.710

<r²>	256.261
(<r²>)^1/2	16.008

All results from a given calculation for CHClCCl2 (Trichloroethylene)

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

States and conformations

All results from a given calculation for CHClCCl₂ (Trichloroethylene)