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	hartrees
Energy at 0K	-874.896959
Energy at 298.15K	-874.903213
HF Energy	-874.305561
Nuclear repulsion energy	221.242429

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3153	3018	5.01
2	A	3139	3005	8.68
3	A	3054	2924	24.38
4	A	1502	1438	0.49
5	A	1496	1432	8.15
6	A	1419	1359	1.34
7	A	1021	978	7.37
8	A	1012	969	2.56
9	A	733	702	0.23
10	A	500	479	0.18
11	A	243	233	1.56
12	A	172	165	0.07
13	A	100	95	1.13
14	B	3152	3018	12.94
15	B	3138	3004	10.11
16	B	3052	2922	23.32
17	B	1507	1443	19.81
18	B	1487	1424	11.31
19	B	1411	1351	2.81
20	B	1019	975	20.97
21	B	1013	970	5.28
22	B	730	699	1.42
23	B	272	260	1.48
24	B	185	177	0.38

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	1.039	-0.505
S2	0.000	-1.039	-0.505
C3	1.204	1.386	0.811
C4	-1.204	-1.386	0.811
H5	1.307	2.475	0.869
H6	0.856	1.014	1.778
H7	2.174	0.945	0.573
H8	-1.307	-2.475	0.869
H9	-0.856	-1.014	1.778
H10	-2.174	-0.945	0.573

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0778	1.8171	3.0104	2.3791	2.4388	2.4283	3.9930	3.1875	3.1343
S2	2.0778		3.0104	1.8171	3.9930	3.1875	3.1343	2.3791	2.4388	2.4283
C3	1.8171	3.0104		3.6716	1.0949	1.0930	1.0920	4.6059	3.3072	4.1106
C4	3.0104	1.8171	3.6716		4.6059	3.3072	4.1106	1.0949	1.0930	1.0920
H5	2.3791	3.9930	1.0949	4.6059		1.7786	1.7827	5.5974	4.2041	4.8886
H6	2.4388	3.1875	1.0930	3.3072	1.7786		1.7868	4.2041	2.6538	3.8038
H7	2.4283	3.1343	1.0920	4.1106	1.7827	1.7868		4.8886	3.8038	4.7404
H8	3.9930	2.3791	4.6059	1.0949	5.5974	4.2041	4.8886		1.7786	1.7827
H9	3.1875	2.4388	3.3072	1.0930	4.2041	2.6538	3.8038	1.7786		1.7868
H10	3.1343	2.4283	4.1106	1.0920	4.8886	3.8038	4.7404	1.7827	1.7868

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	101.021	S1	C3	H5	106.945
S1	C3	H6	111.427	S1	C3	H7	110.687
S2	S1	C3	101.021	S2	C4	H8	106.945
S2	C4	H9	111.427	S2	C4	H10	110.687
H5	C3	H6	108.771	H5	C3	H7	109.214
H6	C3	H7	109.718	H8	C4	H9	108.771
H8	C4	H10	109.214	H9	C4	H10	109.718

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

using model chemistry: QCISD/6-311G*

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: QCISD/6-311G*

States and conformations

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