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	hartrees
Energy at 0K	-628.106509
Energy at 298.15K	-628.112730
Nuclear repulsion energy	289.200166

	hartrees
Energy at 0K	-628.106510
Energy at 298.15K
HF Energy	-627.238015
Nuclear repulsion energy	289.203703

Atom	x (Å)	y (Å)	z (Å)
S1	-0.000	0.347	-0.693
O2	0.000	1.515	0.260
C3	1.318	-0.757	-0.203
C4	-1.318	-0.757	-0.203
C5	2.210	-0.366	0.714
C6	-2.210	-0.366	0.714
H7	1.369	-1.694	-0.748
H8	-1.369	-1.694	-0.748
H9	3.044	-0.999	0.984
H10	-3.044	-0.999	0.984
H11	2.109	0.595	1.204
H12	-2.109	0.595	1.204

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5073	1.7879	1.7879	2.7152	2.7151	2.4584	2.4584	3.7272	3.7271	2.8477	2.8476
O2	1.5073		2.6668	2.6669	2.9371	2.9371	3.6313	3.6314	4.0136	4.0136	2.4871	2.4871
C3	1.7879	2.6668		2.6354	1.3375	3.6655	1.0852	2.8972	2.1088	4.5268	2.1054	3.9430
C4	1.7879	2.6669	2.6354		3.6654	1.3375	2.8972	1.0852	4.5267	2.1088	3.9430	2.1054
C5	2.7152	2.9371	1.3375	3.6654		4.4193	2.1464	4.0875	1.0814	5.2985	1.0833	4.4509
C6	2.7151	2.9371	3.6655	1.3375	4.4193		4.0875	2.1464	5.2985	1.0814	4.4510	1.0833
H7	2.4584	3.6313	1.0852	2.8972	2.1464	4.0875		2.7381	2.5077	4.7915	3.0978	4.5982
H8	2.4584	3.6314	2.8972	1.0852	4.0875	2.1464	2.7381		4.7915	2.5078	4.5983	3.0978
H9	3.7272	4.0136	2.1088	4.5267	1.0814	5.2985	2.5077	4.7915		6.0881	1.8607	5.3979
H10	3.7271	4.0136	4.5268	2.1088	5.2985	1.0814	4.7915	2.5078	6.0881		5.3979	1.8607
H11	2.8477	2.4871	2.1054	3.9430	1.0833	4.4510	3.0978	4.5983	1.8607	5.3979		4.2174
H12	2.8476	2.4871	3.9430	2.1054	4.4509	1.0833	4.5982	3.0978	5.3979	1.8607	4.2174

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	119.934	S1	C3	H7	115.486
S1	C4	C6	119.929	S1	C4	H8	115.485
O2	S1	C3	107.755	O2	S1	C4	107.758
C3	S1	C4	94.955	C3	C5	H9	120.974
C3	C5	H11	120.493	C4	C6	H10	120.975
C4	C6	H12	120.490	C5	C3	H7	124.416
C6	C4	H8	124.420	H9	C5	H11	118.533
H10	C6	H12	118.535

All results from a given calculation for C₄H₆OS (Vinyl sulfoxide)

using model chemistry: MP2/6-31+G**

States and conformations

Conformer 1 (CS)

Conformer 2 ()

	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 C4H6OS (Vinyl sulfoxide)

using model chemistry: MP2/6-31+G**

States and conformations

Conformer 1 (CS)

Conformer 2 ()

All results from a given calculation for C₄H₆OS (Vinyl sulfoxide)