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	hartrees
Energy at 0K	-1274.464963
Energy at 298.15K	-1274.470940
Nuclear repulsion energy	357.812288

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3153	3059	5.92
2	A	3138	3043	0.19
3	A	3040	2949	3.69
4	A	1449	1405	6.74
5	A	1429	1386	8.16
6	A	1311	1272	0.63
7	A	958	929	0.17
8	A	954	926	4.56
9	A	684	664	0.41
10	A	467	453	0.07
11	A	256	249	0.11
12	A	177	171	1.72
13	A	145	141	0.65
14	A	59	57	1.96
15	B	3153	3059	3.37
16	B	3137	3043	5.71
17	B	3039	2948	34.23
18	B	1448	1404	12.66
19	B	1429	1386	7.87
20	B	1314	1274	14.51
21	B	957	928	2.38
22	B	950	921	11.99
23	B	682	662	1.93
24	B	438	425	22.52
25	B	268	260	0.80
26	B	163	158	0.66
27	B	95	92	3.28

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.087
S2	0.000	1.695	-0.160
S3	0.000	-1.695	-0.160
C4	1.764	1.826	-0.645
C5	-1.764	-1.826	-0.645
H6	1.835	2.716	-1.291
H7	-1.835	-2.716	-1.291
H8	2.403	1.956	0.239
H9	2.065	0.936	-1.216
H10	-2.403	-1.956	0.239
H11	-2.065	-0.936	-1.216

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.1037	2.1037	3.0732	3.0732	4.0489	4.0489	3.2123	3.2314	3.2123	3.2314
S2	2.1037		3.3897	1.8341	3.9677	2.3850	4.9091	2.4498	2.4407	4.3888	3.5074
S3	2.1037	3.3897		3.9677	1.8341	4.9091	2.3850	4.3888	3.5074	2.4498	2.4407
C4	3.0732	1.8341	3.9677		5.0774	1.1015	5.8304	1.0987	1.0993	5.6962	4.7556
C5	3.0732	3.9677	1.8341	5.0774		5.8304	1.1015	5.6962	4.7556	1.0987	1.0993
H6	4.0489	2.3850	4.9091	1.1015	5.8304		6.5549	1.7999	1.7962	6.4903	5.3434
H7	4.0489	4.9091	2.3850	5.8304	1.1015	6.5549		6.4903	5.3434	1.7999	1.7962
H8	3.2123	2.4498	4.3888	1.0987	5.6962	1.7999	6.4903		1.8084	6.1968	5.5177
H9	3.2314	2.4407	3.5074	1.0993	4.7556	1.7962	5.3434	1.8084		5.5177	4.5350
H10	3.2123	4.3888	2.4498	5.6962	1.0987	6.4903	1.7999	6.1968	5.5177		1.8084
H11	3.2314	3.5074	2.4407	4.7556	1.0993	5.3434	1.7962	5.5177	4.5350	1.8084

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	102.383	S1	S3	C5	102.383
S2	S1	S3	107.346	S2	C4	H6	105.959
S2	C4	H8	110.781	S2	C4	H9	110.077
S3	C5	H7	105.959	S3	C5	H10	110.781
S3	C5	H11	110.077	H6	C4	H8	109.779
H6	C4	H9	109.405	H7	C5	H10	109.779
H7	C5	H11	109.405	H8	C4	H9	110.723
H10	C5	H11	110.723

All results from a given calculation for CH₃SSSCH₃ (dimethyl trisulfide)

using model chemistry: B3LYP/cc-pVDZ

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	-0.057
2	S	-0.054
3	S	-0.054
4	C	-0.117
5	C	-0.117
6	H	0.061
7	H	0.061
8	H	0.068
9	H	0.070
10	H	0.068
11	H	0.070

	x	y	z
x	10.790	2.743	0.000
y	2.743	14.750	0.000
z	0.000	0.000	8.965

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH3SSSCH3 (dimethyl trisulfide)

using model chemistry: B3LYP/cc-pVDZ

States and conformations

All results from a given calculation for CH₃SSSCH₃ (dimethyl trisulfide)