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	hartrees
Energy at 0K	-629.379511
Energy at 298.15K	-629.385396
Nuclear repulsion energy	285.714708

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3147	3137	0.94
2	A'	3096	3086	9.95
3	A'	3059	3050	2.00
4	A'	1603	1598	3.90
5	A'	1370	1366	14.35
6	A'	1236	1233	1.25
7	A'	1043	1040	72.70
8	A'	974	971	14.87
9	A'	962	959	30.97
10	A'	927	924	13.26
11	A'	669	667	61.99
12	A'	567	565	0.57
13	A'	461	459	1.13
14	A'	281	280	0.71
15	A'	192	192	2.13
16	A'	93	93	0.39
17	A"	3146	3137	0.75
18	A"	3091	3082	2.91
19	A"	3059	3050	6.67
20	A"	1594	1589	12.33
21	A"	1366	1362	1.63
22	A"	1218	1215	14.04
23	A"	967	964	1.69
24	A"	948	946	39.55
25	A"	923	920	3.13
26	A"	551	549	4.85
27	A"	536	535	7.26
28	A"	456	455	6.32
29	A"	235	235	4.56
30	A"	159	159	0.76

Atom	x (Å)	y (Å)	z (Å)
S1	0.606	-0.505	0.000
O2	1.317	0.835	0.000
C3	-0.633	-0.487	1.360
C4	-0.633	-0.487	-1.360
C5	-0.633	0.518	2.231
C6	-0.633	0.518	-2.231
H7	-1.263	-1.373	1.417
H8	-1.263	-1.373	-1.417
H9	-1.313	0.533	3.080
H10	-1.313	0.533	-3.080
H11	0.052	1.355	2.102
H12	0.052	1.355	-2.102

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5168	1.8397	1.8397	2.7495	2.7495	2.5009	2.5009	3.7747	3.7747	2.8610	2.8610
O2	1.5168		2.7198	2.7198	2.9800	2.9800	3.6795	3.6795	4.0616	4.0616	2.5078	2.5078
C3	1.8397	2.7198		2.7207	1.3297	3.7297	1.0892	2.9830	2.1122	4.6066	2.1002	3.9808
C4	1.8397	2.7198	2.7207		3.7297	1.3297	2.9830	1.0892	4.6066	2.1122	3.9808	2.1002
C5	2.7495	2.9800	1.3297	3.7297		4.4630	2.1533	4.1578	1.0880	5.3550	1.0891	4.4661
C6	2.7495	2.9800	3.7297	1.3297	4.4630		4.1578	2.1533	5.3550	1.0880	4.4661	1.0891
H7	2.5009	3.6795	1.0892	2.9830	2.1533	4.1578		2.8346	2.5302	4.8850	3.1050	4.6429
H8	2.5009	3.6795	2.9830	1.0892	4.1578	2.1533	2.8346		4.8850	2.5302	4.6429	3.1050
H9	3.7747	4.0616	2.1122	4.6066	1.0880	5.3550	2.5302	4.8850		6.1601	1.8699	5.4213
H10	3.7747	4.0616	4.6066	2.1122	5.3550	1.0880	4.8850	2.5302	6.1601		5.4213	1.8699
H11	2.8610	2.5078	2.1002	3.9808	1.0891	4.4661	3.1050	4.6429	1.8699	5.4213		4.2035
H12	2.8610	2.5078	3.9808	2.1002	4.4661	1.0891	4.6429	3.1050	5.4213	1.8699	4.2035

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	119.471	S1	C3	H7	114.836
S1	C4	C6	119.471	S1	C4	H8	114.836
O2	S1	C3	107.864	O2	S1	C4	107.864
C3	S1	C4	95.365	C3	C5	H9	121.439
C3	C5	H11	120.183	C4	C6	H10	121.439
C4	C6	H12	120.183	C5	C3	H7	125.498
C6	C4	H8	125.498	H9	C5	H11	118.376
H10	C6	H12	118.376

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

using model chemistry: BLYP/cc-pVTZ

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	0.546
2	O	-0.495
3	C	-0.142
4	C	-0.142
5	C	-0.224
6	C	-0.224
7	H	0.094
8	H	0.094
9	H	0.118
10	H	0.118
11	H	0.128
12	H	0.128

	x	y	z	Total
	-2.719	-1.765	0.000	3.241
CHELPG
AIM
ESP

	x	y	z
x	8.723	0.845	0.000
y	0.845	9.589	0.000
z	0.000	0.000	14.363

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: BLYP/cc-pVTZ

States and conformations

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