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	hartrees
Energy at 0K	-537.362417
Energy at 298.15K	-537.365196
HF Energy	-536.933113
Nuclear repulsion energy	88.699845

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3324	3118	3.68
2	A'	3290	3087	4.91
3	A'	3230	3031	0.02
4	A'	1729	1622	40.62
5	A'	1459	1369	7.80
6	A'	1355	1271	10.05
7	A'	1083	1016	16.16
8	A'	754	707	32.44
9	A'	410	384	0.32
10	A"	998	936	41.97
11	A"	928	870	31.11
12	A"	644	604	9.81

Atom	x (Å)	y (Å)
C1	0.000	0.760
C2	1.300	1.035
Cl3	-0.630	-0.859
H4	-0.779	1.513
H5	2.060	0.261
H6	1.631	2.068

	C1	C2	Cl3	H4	H5	H6
C1		1.3292	1.7376	1.0835	2.1193	2.0912
C2	1.3292		2.7049	2.1334	1.0845	1.0850
Cl3	1.7376	2.7049		2.3772	2.9139	3.6995
H4	1.0835	2.1334	2.3772		3.1025	2.4730
H5	2.1193	1.0845	2.9139	3.1025		1.8578
H6	2.0912	1.0850	3.6995	2.4730	1.8578

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	122.485	C1	C2	H6	119.703
C2	C1	Cl3	123.223	C2	C1	H4	123.997
Cl3	C1	H4	112.779	H5	C2	H6	117.812

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

using model chemistry: MP3=FULL/6-31G*

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: MP3=FULL/6-31G*

States and conformations

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