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	hartrees
Energy at 0K	-629.112988
Energy at 298.15K	-629.104947
HF Energy	-629.375758
Nuclear repulsion energy	289.571912

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3244	3131	0.32
2	A'	3183	3072	7.48
3	A'	3149	3039	1.23
4	A'	1670	1612	1.86
5	A'	1405	1356	12.06
6	A'	1271	1227	0.74
7	A'	1114	1075	75.97
8	A'	1006	971	31.89
9	A'	997	962	6.88
10	A'	968	934	13.83
11	A'	706	682	55.83
12	A'	621	599	0.99
13	A'	489	471	0.98
14	A'	301	290	1.16
15	A'	201	194	2.00
16	A'	92	89	0.35
17	A"	3244	3130	0.74
18	A"	3179	3067	3.78
19	A"	3148	3038	3.47
20	A"	1660	1602	3.47
21	A"	1401	1352	4.39
22	A"	1253	1209	11.25
23	A"	1002	967	12.33
24	A"	978	943	26.30
25	A"	965	931	2.01
26	A"	624	602	8.11
27	A"	565	545	2.49
28	A"	479	462	8.97
29	A"	247	239	4.43
30	A"	168	162	0.80

Atom	x (Å)	y (Å)	z (Å)
S1	0.593	-0.484	0.000
O2	1.275	0.841	0.000
C3	-0.615	-0.490	1.339
C4	-0.615	-0.490	-1.339
C5	-0.615	0.498	2.221
C6	-0.615	0.498	-2.221
H7	-1.245	-1.373	1.386
H8	-1.245	-1.373	-1.386
H9	-1.290	0.505	3.071
H10	-1.290	0.505	-3.071
H11	0.069	1.332	2.100
H12	0.069	1.332	-2.100

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.4899	1.8032	1.8032	2.7127	2.7127	2.4684	2.4684	3.7351	3.7351	2.8252	2.8252
O2	1.4899		2.6714	2.6714	2.9368	2.9368	3.6301	3.6301	4.0150	4.0150	2.4708	2.4708
C3	1.8032	2.6714		2.6771	1.3253	3.6946	1.0860	2.9329	2.1083	4.5700	2.0902	3.9510
C4	1.8032	2.6714	2.6771		3.6946	1.3253	2.9329	1.0860	4.5700	2.1083	3.9510	2.0902
C5	2.7127	2.9368	1.3253	3.6946		4.4427	2.1441	4.1128	1.0846	5.3348	1.0856	4.4536
C6	2.7127	2.9368	3.6946	1.3253	4.4427		4.1128	2.1441	5.3348	1.0846	4.4536	1.0856
H7	2.4684	3.6301	1.0860	2.9329	2.1441	4.1128		2.7726	2.5230	4.8366	3.0914	4.6043
H8	2.4684	3.6301	2.9329	1.0860	4.1128	2.1441	2.7726		4.8366	2.5230	4.6043	3.0914
H9	3.7351	4.0150	2.1083	4.5700	1.0846	5.3348	2.5230	4.8366		6.1411	1.8638	5.4094
H10	3.7351	4.0150	4.5700	2.1083	5.3348	1.0846	4.8366	2.5230	6.1411		5.4094	1.8638
H11	2.8252	2.4708	2.0902	3.9510	1.0856	4.4536	3.0914	4.6043	1.8638	5.4094		4.1991
H12	2.8252	2.4708	3.9510	2.0902	4.4536	1.0856	4.6043	3.0914	5.4094	1.8638	4.1991

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	120.088	S1	C3	H7	115.189
S1	C4	C6	120.088	S1	C4	H8	115.189
O2	S1	C3	108.453	O2	S1	C4	108.453
C3	S1	C4	96.229	C3	C5	H9	121.418
C3	C5	H11	120.357	C4	C6	H10	121.418
C4	C6	H12	120.357	C5	C3	H7	124.519
C6	C4	H8	124.519	H9	C5	H11	118.225
H10	C6	H12	118.225

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

using model chemistry: G4

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	0.309
2	O	-0.357
3	C	-0.092
4	C	-0.092
5	C	-0.295
6	C	-0.295
7	H	0.121
8	H	0.121
9	H	0.131
10	H	0.131
11	H	0.159
12	H	0.159

	x	y	z	Total
	-2.738	-1.662	0.000	3.203
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: G4

States and conformations

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