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	hartrees
Energy at 0K	-77.681315
Energy at 298.15K	-77.682803
HF Energy	-77.398070
Nuclear repulsion energy	27.975941

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3248	3248
2	A'	3201	3201
3	A'	3089	3089
4	A'	1620	1620
5	A'	1382	1382
6	A'	1073	1073
7	A'	730	730
8	A"	896	896
9	A"	777	777

Atom	x (Å)	y (Å)
C1	0.052	0.736
C2	0.052	-0.598
H3	-0.711	1.522
H4	-0.892	-1.172
H5	0.985	-1.179

	C1	C2	H3	H4	H5
C1		1.3341	1.0953	2.1290	2.1302
C2	1.3341		2.2531	1.1048	1.0990
H3	1.0953	2.2531		2.7002	3.1892
H4	2.1290	1.1048	2.7002		1.8768
H5	2.1302	1.0990	3.1892	1.8768

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	H4	121.316		C1	C2	H5	121.906
C2	C1	H3	135.842		H4	C2	H5	116.778

All results from a given calculation for C₂H₃ (vinyl)

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

States and conformations

All results from a given calculation for C₂H₃ (vinyl)