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	hartrees
Energy at 0K	-1274.370272
Energy at 298.15K	-1274.376153
HF Energy	-1274.370272
Nuclear repulsion energy	358.267047

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3110	3057	10.02
2	A	3098	3045	0.32
3	A	3000	2949	4.97
4	A	1454	1429	8.79
5	A	1436	1411	9.78
6	A	1328	1305	0.19
7	A	965	948	0.01
8	A	961	944	3.71
9	A	664	652	0.48
10	A	441	433	0.06
11	A	255	251	0.15
12	A	176	173	1.98
13	A	143	140	0.73
14	A	59	58	2.38
15	B	3110	3057	4.50
16	B	3098	3045	8.11
17	B	3000	2948	44.52
18	B	1453	1428	14.48
19	B	1436	1411	10.60
20	B	1330	1307	8.06
21	B	964	947	2.01
22	B	956	939	10.38
23	B	662	650	1.78
24	B	397	391	33.73
25	B	269	264	0.99
26	B	163	160	0.89
27	B	95	93	3.99

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.075
S2	0.000	1.700	-0.153
S3	0.000	-1.700	-0.153
C4	1.764	1.821	-0.646
C5	-1.764	-1.821	-0.646
H6	1.849	2.710	-1.286
H7	-1.849	-2.710	-1.286
H8	2.405	1.937	0.235
H9	2.055	0.933	-1.218
H10	-2.405	-1.937	0.235
H11	-2.055	-0.933	-1.218

	S1	S2	S3	C4	C5	H6	H7	H8	H9	H10	H11
S1		2.0969	2.0969	3.0644	3.0644	4.0411	4.0411	3.2001	3.2172	3.2001	3.2172
S2	2.0969		3.3996	1.8360	3.9692	2.3917	4.9135	2.4476	2.4385	4.3775	3.5056
S3	2.0969	3.3996		3.9692	1.8360	4.9135	2.3917	4.3775	3.5056	2.4476	2.4385
C4	3.0644	1.8360	3.9692		5.0718	1.0978	5.8305	1.0954	1.0960	5.6821	4.7439
C5	3.0644	3.9692	1.8360	5.0718		5.8305	1.0978	5.6821	4.7439	1.0954	1.0960
H6	4.0411	2.3917	4.9135	1.0978	5.8305		6.5604	1.7940	1.7899	6.4807	5.3400
H7	4.0411	4.9135	2.3917	5.8305	1.0978	6.5604		6.4807	5.3400	1.7940	1.7899
H8	3.2001	2.4476	4.3775	1.0954	5.6821	1.7940	6.4807		1.8006	6.1762	5.4994
H9	3.2172	2.4385	3.5056	1.0960	4.7439	1.7899	5.3400	1.8006		5.4994	4.5145
H10	3.2001	4.3775	2.4476	5.6821	1.0954	6.4807	1.7940	6.1762	5.4994		1.8006
H11	3.2172	3.5056	2.4385	4.7439	1.0960	5.3400	1.7899	5.4994	4.5145	1.8006

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	106.402	S1	S3	C5	106.402
S2	S1	S3	114.627	S2	C4	H6	105.767
S2	C4	H8	112.480	S2	C4	H9	112.568
S3	C5	H7	105.767	S3	C5	H10	112.480
S3	C5	H11	112.568	H6	C4	H8	108.602
H6	C4	H9	108.290	H7	C5	H10	108.602
H7	C5	H11	108.290	H8	C4	H9	108.946
H10	C5	H11	108.946

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

using model chemistry: B97D3/6-31+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	-0.043
2	S	0.028
3	S	0.028
4	C	-0.599
5	C	-0.599
6	H	0.189
7	H	0.189
8	H	0.201
9	H	0.203
10	H	0.201
11	H	0.203

	x	y	z
x	12.128	2.592	0.000
y	2.592	16.986	0.000
z	0.000	0.000	10.825

<r²>	283.271
(<r²>)^1/2	16.831

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

using model chemistry: B97D3/6-31+G**

States and conformations

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