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	hartrees
Energy at 0K	-537.527519
Energy at 298.15K	-537.530277
HF Energy	-537.002191
Nuclear repulsion energy	88.967495

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3300	3144	0.57
2	A'	3246	3093	4.26
3	A'	3193	3043	0.20
4	A'	1651	1573	52.59
5	A'	1408	1342	9.34
6	A'	1306	1244	9.31
7	A'	1043	994	14.22
8	A'	740	705	35.10
9	A'	396	377	0.30
10	A"	977	931	33.94
11	A"	908	865	29.17
12	A"	636	606	12.98

Atom	x (Å)	y (Å)
C1	0.000	0.759
C2	1.301	1.026
Cl3	-0.630	-0.854
H4	-0.773	1.513
H5	2.048	0.247
H6	1.628	2.056

	C1	C2	Cl3	H4	H5	H6
C1		1.3283	1.7321	1.0795	2.1116	2.0817
C2	1.3283		2.6956	2.1301	1.0799	1.0805
Cl3	1.7321	2.6956		2.3717	2.8960	3.6838
H4	1.0795	2.1301	2.3717		3.0922	2.4615
H5	2.1116	1.0799	2.8960	3.0922		1.8575
H6	2.0817	1.0805	3.6838	2.4615	1.8575

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	122.188	C1	C2	H6	119.229
C2	C1	Cl3	122.935	C2	C1	H4	124.092
Cl3	C1	H4	112.973	H5	C2	H6	118.583

All results from a given calculation for C₂H₃Cl (Ethene, chloro-)

using model chemistry: MP2/aug-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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All results from a given calculation for C2H3Cl (Ethene, chloro-)

using model chemistry: MP2/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₂H₃Cl (Ethene, chloro-)