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	hartrees
Energy at 0K	-629.201288
Energy at 298.15K	-629.207155
HF Energy	-629.201288
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3199	3136	2.60
2	A'	3140	3079	13.25
3	A'	3107	3046	2.39
4	A'	1644	1611	2.84
5	A'	1391	1363	11.80
6	A'	1258	1233	1.44
7	A'	1066	1045	68.48
8	A'	987	967	11.57
9	A'	966	947	35.76
10	A'	908	890	23.97
11	A'	678	665	66.69
12	A'	597	585	1.05
13	A'	474	464	0.70
14	A'	289	283	1.05
15	A'	193	189	2.24
16	A'	80	79	0.44
17	A"	3198	3136	2.36
18	A"	3136	3074	5.43
19	A"	3106	3045	7.24
20	A"	1634	1602	7.18
21	A"	1387	1359	1.54
22	A"	1238	1213	13.97
23	A"	977	957	0.01
24	A"	955	937	39.28
25	A"	904	887	10.00
26	A"	593	581	8.00
27	A"	536	526	4.30
28	A"	463	454	6.21
29	A"	234	229	4.99
30	A"	153	150	0.71

Atom	x (Å)	y (Å)	z (Å)
S1	0.602	-0.498	0.000
O2	1.324	0.837	0.000
C3	-0.631	-0.487	1.339
C4	-0.631	-0.487	-1.339
C5	-0.631	0.510	2.227
C6	-0.631	0.510	-2.227
H7	-1.274	-1.369	1.381
H8	-1.274	-1.369	-1.381
H9	-1.322	0.520	3.071
H10	-1.322	0.520	-3.071
H11	0.063	1.345	2.114
H12	0.063	1.345	-2.114

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5173	1.8204	1.8204	2.7377	2.7377	2.4865	2.4865	3.7637	3.7637	2.8554	2.8554
O2	1.5173		2.7142	2.7142	2.9812	2.9812	3.6766	3.6766	4.0656	4.0656	2.5132	2.5132
C3	1.8204	2.7142		2.6790	1.3347	3.7032	1.0921	2.9310	2.1185	4.5763	2.1060	3.9701
C4	1.8204	2.7142	2.6790		3.7032	1.3347	2.9310	1.0921	4.5763	2.1185	3.9701	2.1060
C5	2.7377	2.9812	1.3347	3.7032		4.4542	2.1585	4.1182	1.0905	5.3430	1.0913	4.4747
C6	2.7377	2.9812	3.7032	1.3347	4.4542		4.1182	2.1585	5.3430	1.0905	4.4747	1.0913
H7	2.4865	3.6766	1.0921	2.9310	2.1585	4.1182		2.7616	2.5349	4.8361	3.1123	4.6219
H8	2.4865	3.6766	2.9310	1.0921	4.1182	2.1585	2.7616		4.8361	2.5349	4.6219	3.1123
H9	3.7637	4.0656	2.1185	4.5763	1.0905	5.3430	2.5349	4.8361		6.1423	1.8743	5.4297
H10	3.7637	4.0656	4.5763	2.1185	5.3430	1.0905	4.8361	2.5349	6.1423		5.4297	1.8743
H11	2.8554	2.5132	2.1060	3.9701	1.0913	4.4747	3.1123	4.6219	1.8743	5.4297		4.2279
H12	2.8554	2.5132	3.9701	2.1060	4.4747	1.0913	4.6219	3.1123	5.4297	1.8743	4.2279

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	119.656	S1	C3	H7	115.332
S1	C4	C6	119.656	S1	C4	H8	115.332
O2	S1	C3	109.017	O2	S1	C4	109.017
C3	S1	C4	95.498	C3	C5	H9	121.408
C3	C5	H11	120.030	C4	C6	H10	121.408
C4	C6	H12	120.030	C5	C3	H7	124.865
C6	C4	H8	124.865	H9	C5	H11	118.560
H10	C6	H12	118.560

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

using model chemistry: B97D3/6-31G*

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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Number	Element	Mulliken
1	S	0.748
2	O	-0.585
3	C	-0.304
4	C	-0.304
5	C	-0.313
6	C	-0.313
7	H	0.172
8	H	0.172
9	H	0.167
10	H	0.167
11	H	0.197
12	H	0.197

	x	y	z	Total
	-2.769	-1.677	0.000	3.237
CHELPG
AIM
ESP

	x	y	z
x	7.346	1.150	0.000
y	1.150	8.274	0.000
z	0.000	0.000	12.678

<r²>	197.844
(<r²>)^1/2	14.066

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

using model chemistry: B97D3/6-31G*

States and conformations

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