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	hartrees
Energy at 0K	-1274.452258
Energy at 298.15K	-1274.458454
Nuclear repulsion energy	363.741103

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3191	3053	4.94
2	A	3180	3042	0.00
3	A	3079	2946	3.30
4	A	1481	1417	11.59
5	A	1466	1403	9.92
6	A	1365	1306	0.04
7	A	993	950	0.01
8	A	984	942	4.02
9	A	720	689	0.35
10	A	494	472	0.20
11	A	269	257	0.40
12	A	185	177	1.87
13	A	159	152	1.14
14	A	65	62	2.38
15	B	3191	3053	2.73
16	B	3179	3041	3.94
17	B	3079	2946	31.09
18	B	1480	1416	13.53
19	B	1466	1402	14.59
20	B	1367	1308	3.09
21	B	987	944	0.86
22	B	984	942	14.02
23	B	718	687	1.52
24	B	479	458	21.90
25	B	275	263	1.38
26	B	182	174	0.85
27	B	100	96	3.57

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.063
S2	0.000	1.666	-0.154
S3	0.000	-1.666	-0.154
C4	1.742	1.790	-0.635
C5	-1.742	-1.790	-0.635
H6	1.825	2.670	-1.275
H7	-1.825	-2.670	-1.275
H8	2.379	1.916	0.239
H9	2.043	0.908	-1.200
H10	-2.379	-1.916	0.239
H11	-2.043	-0.908	-1.200

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.0627	2.0627	3.0196	3.0196	3.9902	3.9902	3.1636	3.1812	3.1636	3.1812
S2	2.0627		3.3314	1.8109	3.8993	2.3652	4.8353	2.4241	2.4171	4.3178	3.4487
S3	2.0627	3.3314		3.8993	1.8109	4.8353	2.3652	4.3178	3.4487	2.4241	2.4171
C4	3.0196	1.8109	3.8993		4.9946	1.0913	5.7457	1.0891	1.0899	5.6103	4.6821
C5	3.0196	3.8993	1.8109	4.9946		5.7457	1.0913	5.6103	4.6821	1.0891	1.0899
H6	3.9902	2.3652	4.8353	1.0913	5.7457		6.4669	1.7801	1.7763	6.4024	5.2691
H7	3.9902	4.8353	2.3652	5.7457	1.0913	6.4669		6.4024	5.2691	1.7801	1.7763
H8	3.1636	2.4241	4.3178	1.0891	5.6103	1.7801	6.4024		1.7892	6.1092	5.4408
H9	3.1812	2.4171	3.4487	1.0899	4.6821	1.7763	5.2691	1.7892		5.4408	4.4715
H10	3.1636	4.3178	2.4241	5.6103	1.0891	6.4024	1.7801	6.1092	5.4408		1.7892
H11	3.1812	3.4487	2.4171	4.6821	1.0899	5.2691	1.7763	5.4408	4.4715	1.7892

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	102.238	S1	S3	C5	102.238
S2	S1	S3	107.710	S2	C4	H6	106.515
S2	C4	H8	110.953	S2	C4	H9	110.382
S3	C5	H7	106.515	S3	C5	H10	110.953
S3	C5	H11	110.382	H6	C4	H8	109.452
H6	C4	H9	109.048	H7	C5	H10	109.452
H7	C5	H11	109.048	H8	C4	H9	110.395
H10	C5	H11	110.395

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

using model chemistry: B1B95/6-31+G**

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	-0.042
2	S	0.024
3	S	0.024
4	C	-0.610
5	C	-0.610
6	H	0.195
7	H	0.195
8	H	0.206
9	H	0.206
10	H	0.206
11	H	0.206

	x	y	z
x	11.449	2.298	0.000
y	2.298	15.520	0.000
z	0.000	0.000	10.309

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/6-31+G**

States and conformations

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