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	hartrees
Energy at 0K	-1271.803643
Energy at 298.15K	-1271.810133
Nuclear repulsion energy	365.313414

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3300	2988	8.44
2	A	3281	2971	1.04
3	A	3192	2890	5.54
4	A	1601	1450	5.13
5	A	1581	1432	7.58
6	A	1475	1335	1.52
7	A	1065	965	1.27
8	A	1057	957	1.71
9	A	761	689	0.01
10	A	533	482	0.15
11	A	287	260	0.36
12	A	204	184	1.95
13	A	166	150	0.74
14	A	68	61	2.73
15	B	3300	2988	4.39
16	B	3281	2971	9.01
17	B	3191	2890	40.92
18	B	1600	1449	10.27
19	B	1581	1431	6.17
20	B	1476	1337	17.22
21	B	1063	962	8.49
22	B	1055	955	6.01
23	B	760	688	3.49
24	B	554	501	7.28
25	B	295	267	0.99
26	B	188	170	0.44
27	B	100	90	3.55

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.066
S2	0.000	1.646	-0.157
S3	0.000	-1.646	-0.157
C4	1.740	1.797	-0.633
C5	-1.740	-1.797	-0.633
H6	1.807	2.681	-1.257
H7	-1.807	-2.681	-1.257
H8	2.364	1.920	0.240
H9	2.051	0.932	-1.203
H10	-2.364	-1.920	0.240
H11	-2.051	-0.932	-1.203

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.0504	2.0504	3.0237	3.0237	3.9811	3.9811	3.1557	3.1972	3.1557	3.1972
S2	2.0504		3.2918	1.8101	3.8865	2.3554	4.8162	2.4130	2.4106	4.2968	3.4562
S3	2.0504	3.2918		3.8865	1.8101	4.8162	2.3554	4.2968	3.4562	2.4130	2.4106
C4	3.0237	1.8101	3.8865		5.0018	1.0840	5.7460	1.0808	1.0811	5.6052	4.7052
C5	3.0237	3.8865	1.8101	5.0018		5.7460	1.0840	5.6052	4.7052	1.0808	1.0811
H6	3.9811	2.3554	4.8162	1.0840	5.7460		6.4660	1.7692	1.7666	6.3882	5.2859
H7	3.9811	4.8162	2.3554	5.7460	1.0840	6.4660		6.3882	5.2859	1.7692	1.7666
H8	3.1557	2.4130	4.2968	1.0808	5.6052	1.7692	6.3882		1.7763	6.0913	5.4506
H9	3.1972	2.4106	3.4562	1.0811	4.7052	1.7666	5.2859	1.7763		5.4506	4.5058
H10	3.1557	4.2968	2.4130	5.6052	1.0808	6.3882	1.7692	6.0913	5.4506		1.7763
H11	3.1972	3.4562	2.4106	4.7052	1.0811	5.2859	1.7666	5.4506	4.5058	1.7763

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	102.937	S1	S3	C5	102.937
S2	S1	S3	106.780	S2	C4	H6	106.221
S2	C4	H8	110.617	S2	C4	H9	110.419
S3	C5	H7	106.221	S3	C5	H10	110.617
S3	C5	H11	110.419	H6	C4	H8	109.624
H6	C4	H9	109.363	H7	C5	H10	109.624
H7	C5	H11	109.363	H8	C4	H9	110.499
H10	C5	H11	110.499

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

using model chemistry: HF/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	-0.047
2	S	-0.046
3	S	-0.046
4	C	-0.457
5	C	-0.457
6	H	0.172
7	H	0.172
8	H	0.175
9	H	0.180
10	H	0.175
11	H	0.180

	x	y	z
x	10.466	2.068	0.000
y	2.068	14.026	0.000
z	0.000	0.000	9.448

<r²>	0.000
(<r²>)^1/2	0.000

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

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

States and conformations

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