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	hartrees
Energy at 0K	-1270.702810
Energy at 298.15K	-1270.708601
Nuclear repulsion energy	350.634209

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3145	3081	0.26
2	A	3119	3056	0.46
3	A	3007	2946	1.25
4	A	1454	1425	21.08
5	A	1436	1407	13.95
6	A	1338	1310	2.79
7	A	977	957	3.99
8	A	969	949	5.92
9	A	680	666	0.54
10	A	432	423	0.06
11	A	241	237	0.01
12	A	177	173	0.20
13	A	138	135	4.70
14	A	45	44	1.65
15	B	3145	3081	4.09
16	B	3118	3055	0.30
17	B	3006	2945	11.71
18	B	1452	1422	19.33
19	B	1435	1406	23.80
20	B	1340	1313	5.37
21	B	976	957	5.95
22	B	966	946	20.93
23	B	677	663	1.54
24	B	395	387	29.58
25	B	235	231	1.38
26	B	181	177	1.36
27	B	79	77	7.69

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.236
S2	0.000	1.744	-0.143
S3	0.000	-1.744	-0.143
C4	1.735	1.598	-0.798
C5	-1.735	-1.598	-0.798
H6	1.835	2.351	-1.597
H7	-1.835	-2.351	-1.597
H8	2.465	1.788	0.001
H9	1.871	0.589	-1.222
H10	-2.465	-1.788	0.001
H11	-1.871	-0.589	-1.222

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.2230	2.2230	3.1153	3.1153	4.1133	4.1133	3.2863	3.1445	3.2863	3.1445
S2	2.2230		3.4878	1.8609	3.8226	2.4190	4.7170	2.4699	2.4491	4.3095	3.1794
S3	2.2230	3.4878		3.8226	1.8609	4.7170	2.4190	4.3095	3.1794	2.4699	2.4491
C4	3.1153	1.8609	3.8226		4.7186	1.1016	5.3836	1.0989	1.1026	5.4544	4.2392
C5	3.1153	3.8226	1.8609	4.7186		5.3836	1.1016	5.4544	4.2392	1.0989	1.1026
H6	4.1133	2.4190	4.7170	1.1016	5.3836		5.9649	1.8072	1.8014	6.1787	4.7457
H7	4.1133	4.7170	2.4190	5.3836	1.1016	5.9649		6.1787	4.7457	1.8072	1.8014
H8	3.2863	2.4699	4.3095	1.0989	5.4544	1.8072	6.1787		1.8123	6.0908	5.0940
H9	3.1445	2.4491	3.1794	1.1026	4.2392	1.8014	4.7457	1.8123		5.0940	3.9232
H10	3.2863	4.3095	2.4699	5.4544	1.0989	6.1787	1.8072	6.0908	5.0940		1.8123
H11	3.1445	3.1794	2.4491	4.2392	1.1026	4.7457	1.8014	5.0940	3.9232	1.8123

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	99.043	S1	S3	C5	99.043
S2	S1	S3	103.343	S2	C4	H6	106.654
S2	C4	H8	110.471	S2	C4	H9	108.758
S3	C5	H7	106.654	S3	C5	H10	110.471
S3	C5	H11	108.758	H6	C4	H8	110.425
H6	C4	H9	109.617	H7	C5	H10	110.425
H7	C5	H11	109.617	H8	C4	H9	110.813
H10	C5	H11	110.813

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

using model chemistry: LSDA/6-31G

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	0.078
3	S	0.078
4	C	-0.736
5	C	-0.736
6	H	0.224
7	H	0.224
8	H	0.230
9	H	0.235
10	H	0.230
11	H	0.235

	x	y	z
x	9.976	2.220	0.000
y	2.220	15.640	0.000
z	0.000	0.000	9.826

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: LSDA/6-31G

States and conformations

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