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	hartrees
Energy at 0K	-874.440623
Energy at 298.15K	-874.446549
Nuclear repulsion energy	210.614897

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3246	3036	5.72
2	A	3229	3020	7.36
3	A	3133	2930	18.16
4	A	1558	1457	0.05
5	A	1545	1445	10.17
6	A	1450	1356	3.06
7	A	1037	970	7.00
8	A	1034	967	1.74
9	A	683	639	1.28
10	A	438	409	0.00
11	A	207	193	1.22
12	A	138	129	0.00
13	A	77	72	1.99
14	B	3246	3036	9.53
15	B	3228	3019	2.82
16	B	3129	2926	16.81
17	B	1561	1460	21.52
18	B	1540	1441	12.84
19	B	1444	1351	7.07
20	B	1037	970	17.70
21	B	1032	965	2.69
22	B	679	635	0.84
23	B	236	221	1.61
24	B	149	139	0.52

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	1.124	-0.516
S2	0.000	-1.124	-0.516
C3	1.276	1.470	0.835
C4	-1.276	-1.470	0.835
H5	1.378	2.557	0.878
H6	0.924	1.093	1.796
H7	2.228	1.014	0.569
H8	-1.378	-2.557	0.878
H9	-0.924	-1.093	1.796
H10	-2.228	-1.014	0.569

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.2472	1.8905	3.1909	2.4287	2.4898	2.4808	4.1702	3.3336	3.2727
S2	2.2472		3.1909	1.8905	4.1702	3.3336	3.2727	2.4287	2.4898	2.4808
C3	1.8905	3.1909		3.8932	1.0924	1.0902	1.0893	4.8234	3.5118	4.3035
C4	3.1909	1.8905	3.8932		4.8234	3.5118	4.3035	1.0924	1.0902	1.0893
H5	2.4287	4.1702	1.0924	4.8234		1.7863	1.7888	5.8097	4.4121	5.0847
H6	2.4898	3.3336	1.0902	3.5118	1.7863		1.7926	4.4121	2.8627	3.9851
H7	2.4808	3.2727	1.0893	4.3035	1.7888	1.7926		5.0847	3.9851	4.8961
H8	4.1702	2.4287	4.8234	1.0924	5.8097	4.4121	5.0847		1.7863	1.7888
H9	3.3336	2.4898	3.5118	1.0902	4.4121	2.8627	3.9851	1.7863		1.7926
H10	3.2727	2.4808	4.3035	1.0893	5.0847	3.9851	4.8961	1.7888	1.7926

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	100.565	S1	C3	H5	105.891
S1	C3	H6	110.396	S1	C3	H7	109.776
S2	S1	C3	100.565	S2	C4	H8	105.891
S2	C4	H9	110.396	S2	C4	H10	109.776
H5	C3	H6	109.860	H5	C3	H7	110.146
H6	C3	H7	110.665	H8	C4	H9	109.860
H8	C4	H10	110.146	H9	C4	H10	110.665

All results from a given calculation for CH₃SSCH₃ (Disulfide, dimethyl)

using model chemistry: CID/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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All results from a given calculation for CH3SSCH3 (Disulfide, dimethyl)

using model chemistry: CID/6-31G

States and conformations

All results from a given calculation for CH₃SSCH₃ (Disulfide, dimethyl)