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	hartrees
Energy at 0K	-1450.775232
Energy at 298.15K	-1450.776389
Nuclear repulsion energy	317.834799

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3272	3124	14.81
2	A'	1669	1594	10.52
3	A'	1319	1259	6.04
4	A'	927	885	100.54
5	A'	846	808	106.37
6	A'	639	610	14.10
7	A'	396	378	0.19
8	A'	282	269	0.33
9	A'	184	175	1.04
10	A"	867	828	40.42
11	A"	497	474	7.54
12	A"	214	204	0.33

Atom	x (Å)	y (Å)
C1	-1.049	-0.375
C2	0.000	0.442
H3	-2.057	0.012
Cl4	-0.912	-2.087
Cl5	-0.228	2.158
Cl6	1.631	-0.096

	C1	C2	H3	Cl4	Cl5	Cl6
C1		1.3297	1.0796	1.7176	2.6626	2.6948
C2	1.3297		2.1017	2.6886	1.7309	1.7177
H3	1.0796	2.1017		2.3908	2.8199	3.6900
Cl4	1.7176	2.6886	2.3908		4.2997	3.2300
Cl5	2.6626	1.7309	2.8199	4.2997		2.9218
Cl6	2.6948	1.7177	3.6900	3.2300	2.9218

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	120.341	C1	C2	Cl6	123.834
C2	C1	H3	121.106	C2	C1	Cl4	123.337
H3	C1	Cl4	115.557	Cl5	C2	Cl6	115.825

All results from a given calculation for CHClCCl₂ (Trichloroethylene)

using model chemistry: B1B95/3-21G*

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	-0.314
2	C	-0.308
3	H	0.294
4	Cl	0.084
5	Cl	0.112
6	Cl	0.132

	x	y	z	Total
	-0.961	0.239	0.000	0.990
CHELPG
AIM
ESP

	x	y	z
x	7.772	0.789	0.000
y	0.789	10.492	0.000
z	0.000	0.000	2.996

<r²>	256.736
(<r²>)^1/2	16.023

All results from a given calculation for CHClCCl2 (Trichloroethylene)

using model chemistry: B1B95/3-21G*

States and conformations

All results from a given calculation for CHClCCl₂ (Trichloroethylene)