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	hartrees
Energy at 0K	-1439.068174
Energy at 298.15K	-1439.069260
Nuclear repulsion energy	311.714320

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3719	3037	77.00
2	A'	1994	1628	2.14
3	A'	1446	1181	25.32
4	A'	1148	938	76.29
5	A'	1000	816	61.68
6	A'	710	580	16.87
7	A'	425	347	0.37
8	A'	283	231	3.09
9	A'	173	141	2.10
10	A"	992	810	12.42
11	A"	515	421	0.10
12	A"	230	188	7.63

Atom	x (Å)	y (Å)
C1	-1.065	-0.336
C2	0.000	0.440
H3	-2.071	0.073
Cl4	-0.986	-2.098
Cl5	-0.183	2.206
Cl6	1.667	-0.149

	C1	C2	H3	Cl4	Cl5	Cl6
C1		1.3179	1.0863	1.7637	2.6911	2.7381
C2	1.3179		2.1034	2.7235	1.7754	1.7681
H3	1.0863	2.1034		2.4269	2.8489	3.7446
Cl4	1.7637	2.7235	2.4269		4.3788	3.2925
Cl5	2.6911	1.7754	2.8489	4.3788		2.9950
Cl6	2.7381	1.7681	3.7446	3.2925	2.9950

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	120.192	C1	C2	Cl6	124.421
C2	C1	H3	121.766	C2	C1	Cl4	123.565
H3	C1	Cl4	114.668	Cl5	C2	Cl6	115.387

All results from a given calculation for CHClCCl₂ (Trichloroethylene)

using model chemistry: HF/STO-3G

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	-0.006
2	C	0.081
3	H	0.134
4	Cl	-0.081
5	Cl	-0.070
6	Cl	-0.058

	x	y	z	Total
	-1.566	0.488	0.000	1.641
CHELPG
AIM
ESP

	x	y	z
x	4.395	0.564	0.000
y	0.564	6.304	0.000
z	0.000	0.000	0.515

<r²>	264.980
(<r²>)^1/2	16.278

All results from a given calculation for CHClCCl2 (Trichloroethylene)

using model chemistry: HF/STO-3G

States and conformations

All results from a given calculation for CHClCCl₂ (Trichloroethylene)