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	hartrees
Energy at 0K	-1274.320744
Energy at 298.15K	-1274.326515
Nuclear repulsion energy	355.135067

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3080	3063	7.34
2	A	3062	3045	0.36
3	A	2976	2959	2.95
4	A	1438	1430	4.26
5	A	1420	1412	6.34
6	A	1294	1286	1.20
7	A	936	931	0.05
8	A	934	928	4.31
9	A	645	641	0.43
10	A	446	444	0.05
11	A	243	242	0.06
12	A	168	167	1.77
13	A	132	131	0.46
14	A	62	61	2.36
15	B	3080	3063	3.26
16	B	3062	3045	7.14
17	B	2976	2959	27.64
18	B	1437	1429	11.25
19	B	1420	1412	4.72
20	B	1295	1288	21.97
21	B	937	931	2.31
22	B	927	922	10.87
23	B	643	639	1.61
24	B	410	408	30.91
25	B	260	259	0.68
26	B	147	146	0.55
27	B	93	92	3.35

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.050
S2	0.000	1.717	-0.163
S3	0.000	-1.717	-0.163
C4	1.782	1.923	-0.611
C5	-1.782	-1.923	-0.611
H6	1.838	2.845	-1.209
H7	-1.838	-2.845	-1.209
H8	2.396	2.028	0.292
H9	2.120	1.072	-1.216
H10	-2.396	-2.028	0.292
H11	-2.120	-1.072	-1.216

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.1022	2.1022	3.1037	3.1037	4.0714	4.0714	3.2293	3.2832	3.2293	3.2832
S2	2.1022		3.4332	1.8488	4.0772	2.3968	5.0281	2.4590	2.4531	4.4686	3.6579
S3	2.1022	3.4332		4.0772	1.8488	5.0281	2.3968	4.4686	3.6579	2.4590	2.4531
C4	3.1037	1.8488	4.0772		5.2436	1.1004	6.0165	1.0971	1.0976	5.8208	4.9562
C5	3.1037	4.0772	1.8488	5.2436		6.0165	1.1004	5.8208	4.9562	1.0971	1.0976
H6	4.0714	2.3968	5.0281	1.1004	6.0165		6.7744	1.7982	1.7953	6.6276	5.5688
H7	4.0714	5.0281	2.3968	6.0165	1.1004	6.7744		6.6276	5.5688	1.7982	1.7953
H8	3.2293	2.4590	4.4686	1.0971	5.8208	1.7982	6.6276		1.8063	6.2781	5.6816
H9	3.2832	2.4531	3.6579	1.0976	4.9562	1.7953	5.5688	1.8063		5.6816	4.7516
H10	3.2293	4.4686	2.4590	5.8208	1.0971	6.6276	1.7982	6.2781	5.6816		1.8063
H11	3.2832	3.6579	2.4531	4.9562	1.0976	5.5688	1.7953	5.6816	4.7516	1.8063

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	103.357	S1	S3	C5	103.357
S2	S1	S3	109.487	S2	C4	H6	105.917
S2	C4	H8	110.561	S2	C4	H9	110.105
S3	C5	H7	105.917	S3	C5	H10	110.561
S3	C5	H11	110.105	H6	C4	H8	109.823
H6	C4	H9	109.534	H7	C5	H10	109.823
H7	C5	H11	109.534	H8	C4	H9	110.783
H10	C5	H11	110.783

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

using model chemistry: BLYP/6-31G(2df,p)

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	-0.059
2	S	-0.065
3	S	-0.065
4	C	-0.331
5	C	-0.331
6	H	0.136
7	H	0.136
8	H	0.142
9	H	0.147
10	H	0.142
11	H	0.147

	x	y	z
x	11.373	2.865	0.000
y	2.865	16.735	0.000
z	0.000	0.000	9.874

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

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