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	hartrees
Energy at 0K	-1274.537644
Energy at 298.15K	-1274.543874
Nuclear repulsion energy	363.696174

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3177	3051	6.22
2	A	3164	3038	0.00
3	A	3070	2948	3.18
4	A	1475	1416	15.07
5	A	1464	1406	6.24
6	A	1363	1309	0.30
7	A	995	956	0.31
8	A	986	946	7.90
9	A	718	689	0.23
10	A	481	462	0.25
11	A	270	259	0.28
12	A	190	183	1.26
13	A	164	158	2.15
14	A	66	63	2.57
15	B	3177	3050	4.04
16	B	3164	3038	5.89
17	B	3070	2948	29.94
18	B	1474	1415	10.09
19	B	1464	1405	17.85
20	B	1365	1311	4.37
21	B	990	951	5.24
22	B	986	946	16.13
23	B	716	688	2.13
24	B	462	444	22.06
25	B	275	264	1.54
26	B	196	188	0.96
27	B	100	96	3.37

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.069
S2	0.000	1.668	-0.158
S3	0.000	-1.668	-0.158
C4	1.742	1.772	-0.634
C5	-1.742	-1.772	-0.634
H6	1.836	2.655	-1.265
H7	-1.836	-2.655	-1.265
H8	2.374	1.882	0.243
H9	2.031	0.892	-1.204
H10	-2.374	-1.882	0.243
H11	-2.031	-0.892	-1.204

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.0705	2.0705	3.0125	3.0125	3.9841	3.9841	3.1403	3.1762	3.1403	3.1762
S2	2.0705		3.3350	1.8085	3.8847	2.3609	4.8252	2.4172	2.4126	4.2891	3.4306
S3	2.0705	3.3350		3.8847	1.8085	4.8252	2.3609	4.2891	3.4306	2.4172	2.4126
C4	3.0125	1.8085	3.8847		4.9692	1.0895	5.7271	1.0869	1.0878	5.5732	4.6533
C5	3.0125	3.8847	1.8085	4.9692		5.7271	1.0895	5.5732	4.6533	1.0869	1.0878
H6	3.9841	2.3609	4.8252	1.0895	5.7271		6.4564	1.7781	1.7749	6.3709	5.2479
H7	3.9841	4.8252	2.3609	5.7271	1.0895	6.4564		6.3709	5.2479	1.7781	1.7749
H8	3.1403	2.4172	4.2891	1.0869	5.5732	1.7781	6.3709		1.7865	6.0592	5.4030
H9	3.1762	2.4126	3.4306	1.0878	4.6533	1.7749	5.2479	1.7865		5.4030	4.4364
H10	3.1403	4.2891	2.4172	5.5732	1.0869	6.3709	1.7781	6.0592	5.4030		1.7865
H11	3.1762	3.4306	2.4126	4.6533	1.0878	5.2479	1.7749	5.4030	4.4364	1.7865

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	101.694	S1	S3	C5	101.694
S2	S1	S3	107.292	S2	C4	H6	106.458
S2	C4	H8	110.719	S2	C4	H9	110.326
S3	C5	H7	106.458	S3	C5	H10	110.719
S3	C5	H11	110.326	H6	C4	H8	109.567
H6	C4	H9	109.211	H7	C5	H10	109.567
H7	C5	H11	109.211	H8	C4	H9	110.467
H10	C5	H11	110.467

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

using model chemistry: B1B95/6-311G**

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	-0.053
2	S	0.020
3	S	0.020
4	C	-0.516
5	C	-0.516
6	H	0.165
7	H	0.165
8	H	0.177
9	H	0.180
10	H	0.177
11	H	0.180

	x	y	z
x	10.989	2.121	0.000
y	2.121	14.734	0.000
z	0.000	0.000	9.636

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/6-311G**

States and conformations

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