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	hartrees
Energy at 0K	-1260.053881
Energy at 298.15K	-1260.059602
Nuclear repulsion energy	353.965524

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3352	3101	0.76
2	A	3334	3084	8.39
3	A	3174	2936	0.36
4	A	1639	1517	3.56
5	A	1625	1504	4.31
6	A	1483	1372	1.91
7	A	1022	946	0.87
8	A	1019	943	2.75
9	A	769	711	0.75
10	A	537	497	0.47
11	A	253	234	0.83
12	A	178	164	1.07
13	A	132	122	0.01
14	A	55	51	0.37
15	B	3352	3101	3.14
16	B	3333	3084	4.67
17	B	3173	2936	11.39
18	B	1639	1516	9.51
19	B	1625	1504	4.27
20	B	1481	1370	35.27
21	B	1022	946	6.26
22	B	1016	940	6.49
23	B	766	708	2.04
24	B	502	464	20.23
25	B	273	252	0.93
26	B	141	130	0.14
27	B	79	73	0.44

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.086
S2	0.000	1.697	-0.213
S3	0.000	-1.697	-0.213
C4	1.818	1.845	-0.558
C5	-1.818	-1.845	-0.558
H6	1.968	2.729	-1.211
H7	-1.968	-2.729	-1.211
H8	2.410	1.993	0.369
H9	2.214	0.953	-1.088
H10	-2.410	-1.993	0.369
H11	-2.214	-0.953	-1.088

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.1374	2.1374	3.0683	3.0683	4.0744	4.0744	3.2087	3.2461	3.2087	3.2461
S2	2.1374		3.3940	1.8563	3.9964	2.4361	4.9456	2.4970	2.4940	4.4458	3.5619
S3	2.1374	3.3940		3.9964	1.8563	4.9456	2.4361	4.4458	3.5619	2.4970	2.4940
C4	3.0683	1.8563	3.9964		5.1805	1.1091	5.9735	1.1103	1.1108	5.7852	4.9359
C5	3.0683	3.9964	1.8563	5.1805		5.9735	1.1091	5.7852	4.9359	1.1103	1.1108
H6	4.0744	2.4361	4.9456	1.1091	5.9735		6.7292	1.7987	1.7974	6.6306	5.5729
H7	4.0744	4.9456	2.4361	5.9735	1.1091	6.7292		6.6306	5.5729	1.7987	1.7974
H8	3.2087	2.4970	4.4458	1.1103	5.7852	1.7987	6.6306		1.8014	6.2549	5.6729
H9	3.2461	2.4940	3.5619	1.1108	4.9359	1.7974	5.5729	1.8014		5.6729	4.8200
H10	3.2087	4.4458	2.4970	5.7852	1.1103	6.6306	1.7987	6.2549	5.6729		1.8014
H11	3.2461	3.5619	2.4940	4.9359	1.1108	5.5729	1.7974	5.6729	4.8200	1.8014

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	100.164	S1	S3	C5	100.164
S2	S1	S3	105.111	S2	C4	H6	107.798
S2	C4	H8	112.185	S2	C4	H9	111.930
S3	C5	H7	107.798	S3	C5	H10	112.185
S3	C5	H11	111.930	H6	C4	H8	108.272
H6	C4	H9	108.122	H7	C5	H10	108.272
H7	C5	H11	108.122	H8	C4	H9	108.394
H10	C5	H11	108.394

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

using model chemistry: BLYP/STO-3G

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	-0.005
2	S	0.075
3	S	0.075
4	C	-0.298
5	C	-0.298
6	H	0.078
7	H	0.078
8	H	0.074
9	H	0.073
10	H	0.074
11	H	0.073

	x	y	z
x	5.428	2.194	0.000
y	2.194	8.775	0.000
z	0.000	0.000	4.113

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: BLYP/STO-3G

States and conformations

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