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	hartrees
Energy at 0K	-44.149618
Energy at 298.15K	-44.155753
Nuclear repulsion energy	86.604269

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3331	3040	15.30
2	A	3316	3026	0.50
3	A	3190	2911	6.27
4	A	1607	1466	8.81
5	A	1591	1452	13.27
6	A	1494	1363	1.96
7	A	1092	996	0.28
8	A	1091	995	5.01
9	A	715	652	0.71
10	A	461	421	0.10
11	A	247	226	0.19
12	A	178	162	2.23
13	A	145	132	1.68
14	A	56	51	4.18
15	B	3331	3040	9.20
16	B	3316	3026	9.40
17	B	3189	2910	61.46
18	B	1606	1465	14.14
19	B	1591	1451	13.08
20	B	1496	1365	20.91
21	B	1091	996	2.58
22	B	1088	992	19.05
23	B	715	652	12.53
24	B	489	447	1.35
25	B	250	229	1.40
26	B	169	155	0.64
27	B	80	73	4.56

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.164
S2	0.000	1.751	-0.182
S3	0.000	-1.751	-0.182
C4	1.808	1.835	-0.677
C5	-1.808	-1.835	-0.677
H6	1.896	2.697	-1.324
H7	-1.896	-2.697	-1.324
H8	2.419	1.961	0.204
H9	2.080	0.937	-1.211
H10	-2.419	-1.961	0.204
H11	-2.080	-0.937	-1.211

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.2083	2.2083	3.1657	3.1657	4.1302	4.1302	3.2582	3.2928	3.2582	3.2928
S2	2.2083		3.5013	1.8760	4.0459	2.4070	4.9679	2.4585	2.4590	4.4468	3.5508
S3	2.2083	3.5013		4.0459	1.8760	4.9679	2.4070	4.4468	3.5508	2.4585	2.4590
C4	3.1657	1.8760	4.0459		5.1517	1.0819	5.8885	1.0792	1.0797	5.7486	4.8047
C5	3.1657	4.0459	1.8760	5.1517		5.8885	1.0819	5.7486	4.8047	1.0792	1.0797
H6	4.1302	2.4070	4.9679	1.0819	5.8885		6.5933	1.7754	1.7734	6.5304	5.3877
H7	4.1302	4.9679	2.4070	5.8885	1.0819	6.5933		6.5304	5.3877	1.7754	1.7734
H8	3.2582	2.4585	4.4468	1.0792	5.7486	1.7754	6.5304		1.7787	6.2274	5.5353
H9	3.2928	2.4590	3.5508	1.0797	4.8047	1.7734	5.3877	1.7787		5.5353	4.5631
H10	3.2582	4.4468	2.4585	5.7486	1.0792	6.5304	1.7754	6.2274	5.5353		1.7787
H11	3.2928	3.5508	2.4590	4.8047	1.0797	5.3877	1.7734	5.5353	4.5631	1.7787

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	101.317	S1	S3	C5	101.317
S2	S1	S3	104.886	S2	C4	H6	105.778
S2	C4	H8	109.626	S2	C4	H9	109.640
S3	C5	H7	105.778	S3	C5	H10	109.626
S3	C5	H11	109.640	H6	C4	H8	110.470
H6	C4	H9	110.248	H7	C5	H10	110.470
H7	C5	H11	110.248	H8	C4	H9	110.947
H10	C5	H11	110.947

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

using model chemistry: HF/CEP-121G

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	-0.070
2	S	0.066
3	S	0.066
4	C	-0.630
5	C	-0.630
6	H	0.195
7	H	0.195
8	H	0.201
9	H	0.203
10	H	0.201
11	H	0.203

	x	y	z
x	10.789	2.547	0.000
y	2.547	16.125	0.000
z	0.000	0.000	9.916

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/CEP-121G

States and conformations

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