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	hartrees
Energy at 0K	-629.191128
Energy at 298.15K	-629.197370
HF Energy	-629.191128
Nuclear repulsion energy	290.534695

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3282	3108	0.57
2	A'	3232	3061	3.58
3	A'	3183	3014	3.77
4	A'	1721	1630	0.90
5	A'	1427	1351	13.17
6	A'	1284	1216	0.78
7	A'	1112	1053	79.86
8	A'	1015	961	34.31
9	A'	1008	955	28.75
10	A'	981	929	12.06
11	A'	727	688	68.47
12	A'	658	623	7.71
13	A'	507	480	1.28
14	A'	309	293	3.05
15	A'	216	205	2.69
16	A'	88	83	0.68
17	A"	3282	3108	0.63
18	A"	3229	3057	3.48
19	A"	3182	3014	2.01
20	A"	1711	1620	2.11
21	A"	1422	1347	4.27
22	A"	1265	1198	11.40
23	A"	1010	956	18.20
24	A"	990	938	30.36
25	A"	978	926	4.64
26	A"	677	641	12.23
27	A"	569	538	4.86
28	A"	492	466	9.77
29	A"	271	256	7.70
30	A"	157	149	0.55

Atom	x (Å)	y (Å)	z (Å)
S1	0.606	-0.535	0.000
O2	1.250	0.837	0.000
C3	-0.616	-0.500	1.334
C4	-0.616	-0.500	-1.334
C5	-0.616	0.553	2.130
C6	-0.616	0.553	-2.130
H7	-1.239	-1.385	1.428
H8	-1.239	-1.385	-1.428
H9	-1.294	0.628	2.973
H10	-1.294	0.628	-2.973
H11	0.077	1.367	1.930
H12	0.077	1.367	-1.930

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5156	1.8101	1.8101	2.6857	2.6857	2.4829	2.4829	3.7147	3.7147	2.7606	2.7606
O2	1.5156		2.6559	2.6559	2.8460	2.8460	3.6292	3.6292	3.9185	3.9185	2.3199	2.3199
C3	1.8101	2.6559		2.6688	1.3200	3.6207	1.0855	2.9663	2.1014	4.5036	2.0789	3.8240
C4	1.8101	2.6559	2.6688		3.6207	1.3200	2.9663	1.0855	4.5036	2.1014	3.8240	2.0789
C5	2.6857	2.8460	1.3200	3.6207		4.2593	2.1531	4.0985	1.0844	5.1476	1.0873	4.1979
C6	2.6857	2.8460	3.6207	1.3200	4.2593		4.0985	2.1531	5.1476	1.0844	4.1979	1.0873
H7	2.4829	3.6292	1.0855	2.9663	2.1531	4.0985		2.8554	2.5377	4.8390	3.0911	4.5361
H8	2.4829	3.6292	2.9663	1.0855	4.0985	2.1531	2.8554		4.8390	2.5377	4.5361	3.0911
H9	3.7147	3.9185	2.1014	4.5036	1.0844	5.1476	2.5377	4.8390		5.9451	1.8744	5.1440
H10	3.7147	3.9185	4.5036	2.1014	5.1476	1.0844	4.8390	2.5377	5.9451		5.1440	1.8744
H11	2.7606	2.3199	2.0789	3.8240	1.0873	4.1979	3.0911	4.5361	1.8744	5.1440		3.8598
H12	2.7606	2.3199	3.8240	2.0789	4.1979	1.0873	4.5361	3.0911	5.1440	1.8744	3.8598

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	117.335	S1	C3	H7	115.798
S1	C4	C6	117.335	S1	C4	H8	115.798
O2	S1	C3	105.656	O2	S1	C4	105.656
C3	S1	C4	94.989	C3	C5	H9	121.544
C3	C5	H11	119.126	C4	C6	H10	121.544
C4	C6	H12	119.126	C5	C3	H7	126.768
C6	C4	H8	126.768	H9	C5	H11	119.329
H10	C6	H12	119.329

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

using model chemistry: M06-2X/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	0.817
2	O	-0.662
3	C	-0.349
4	C	-0.349
5	C	-0.334
6	C	-0.334
7	H	0.198
8	H	0.198
9	H	0.184
10	H	0.184
11	H	0.224
12	H	0.224

	x	y	z	Total
	-2.924	-1.842	0.000	3.456
CHELPG
AIM
ESP

	x	y	z
x	6.907	1.036	0.000
y	1.036	8.229	0.000
z	0.000	0.000	11.679

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: M06-2X/6-31G*

States and conformations

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