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	hartrees
Energy at 0K	-77.694876
Energy at 298.15K	-77.696361
HF Energy	-77.401015
Nuclear repulsion energy	27.967695

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3232	3232
2	A'	3191	3191
3	A'	3075	3075
4	A'	1604	1604
5	A'	1380	1380
6	A'	1066	1066
7	A'	726	726
8	A"	904	904
9	A"	763	763

Atom	x (Å)	y (Å)
C1	0.051	0.737
C2	0.051	-0.599
H3	-0.707	1.525
H4	-0.892	-1.171
H5	0.982	-1.180

	C1	C2	H3	H4	H5
C1		1.3363	1.0938	2.1281	2.1303
C2	1.3363		2.2558	1.1031	1.0964
H3	1.0938	2.2558		2.7021	3.1886
H4	2.1281	1.1031	2.7021		1.8740
H5	2.1303	1.0964	3.1886	1.8740

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	H4	121.181		C1	C2	H5	121.954
C2	C1	H3	136.113		H4	C2	H5	116.865

All results from a given calculation for C₂H₃ (vinyl)

using model chemistry: QCISD(TQ)=FULL/aug-cc-pVDZ

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 C2H3 (vinyl)

using model chemistry: QCISD(TQ)=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₂H₃ (vinyl)