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	hartrees
Energy at 0K	-1270.972020
Energy at 298.15K	-1270.978066
Nuclear repulsion energy	369.023944

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3078	3044	0.34
2	A	3061	3027	0.31
3	A	2965	2933	3.11
4	A	1394	1379	9.60
5	A	1375	1360	9.90
6	A	1259	1245	0.62
7	A	927	917	1.02
8	A	924	914	3.29
9	A	716	708	1.29
10	A	498	493	0.02
11	A	269	266	0.04
12	A	176	174	1.19
13	A	153	151	1.78
14	A	50	50	1.33
15	B	3078	3044	2.32
16	B	3060	3026	0.43
17	B	2965	2932	21.05
18	B	1392	1377	12.32
19	B	1374	1359	11.91
20	B	1262	1248	5.68
21	B	930	920	1.55
22	B	917	907	14.74
23	B	713	705	3.73
24	B	464	459	24.15
25	B	273	270	0.77
26	B	172	170	0.96
27	B	92	91	5.18

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.108
S2	0.000	1.634	-0.127
S3	0.000	-1.634	-0.127
C4	1.695	1.633	-0.714
C5	-1.695	-1.633	-0.714
H6	1.781	2.438	-1.456
H7	-1.781	-2.438	-1.456
H8	2.396	1.810	0.110
H9	1.907	0.671	-1.202
H10	-2.396	-1.810	0.110
H11	-1.907	-0.671	-1.202

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.0489	2.0489	2.9764	2.9764	3.9618	3.9618	3.1646	3.0698	3.1646	3.0698
S2	2.0489		3.2686	1.7935	3.7269	2.3632	4.6396	2.4145	2.3915	4.2026	3.1788
S3	2.0489	3.2686		3.7269	1.7935	4.6396	2.3632	4.2026	3.1788	2.4145	2.3915
C4	2.9764	1.7935	3.7269		4.7067	1.0990	5.4043	1.0967	1.0992	5.4101	4.3032
C5	2.9764	3.7269	1.7935	4.7067		5.4043	1.0990	5.4101	4.3032	1.0967	1.0992
H6	3.9618	2.3632	4.6396	1.0990	5.4043		6.0392	1.7966	1.7903	6.1606	4.8305
H7	3.9618	4.6396	2.3632	5.4043	1.0990	6.0392		6.1606	4.8305	1.7966	1.7903
H8	3.1646	2.4145	4.2026	1.0967	5.4101	1.7966	6.1606		1.8051	6.0061	5.1375
H9	3.0698	2.3915	3.1788	1.0992	4.3032	1.7903	4.8305	1.8051		5.1375	4.0431
H10	3.1646	4.2026	2.4145	5.4101	1.0967	6.1606	1.7966	6.0061	5.1375		1.8051
H11	3.0698	3.1788	2.3915	4.3032	1.0992	4.8305	1.7903	5.1375	4.0431	1.8051

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	101.334	S1	S3	C5	101.334
S2	S1	S3	105.812	S2	C4	H6	107.114
S2	C4	H8	111.009	S2	C4	H9	109.167
S3	C5	H7	107.114	S3	C5	H10	111.009
S3	C5	H11	109.167	H6	C4	H8	109.815
H6	C4	H9	109.066	H7	C5	H10	109.815
H7	C5	H11	109.066	H8	C4	H9	110.587
H10	C5	H11	110.587

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

using model chemistry: LSDA/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	-0.061
2	S	-0.032
3	S	-0.032
4	C	-0.345
5	C	-0.345
6	H	0.127
7	H	0.127
8	H	0.142
9	H	0.139
10	H	0.142
11	H	0.139

	x	y	z
x	12.261	2.535	0.000
y	2.535	15.845	0.000
z	0.000	0.000	10.812

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: LSDA/cc-pVTZ

States and conformations

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