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	hartrees
Energy at 0K	-34.834446
Energy at 298.15K	-34.840653
HF Energy	-34.341493
Nuclear repulsion energy	64.635307

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3217	3054	9.35
2	A	3202	3040	10.39
3	A	3093	2936	28.77
4	A	1498	1422	0.28
5	A	1484	1409	7.54
6	A	1400	1329	2.71
7	A	1004	953	5.85
8	A	1001	950	1.91
9	A	737	700	0.23
10	A	532	505	0.33
11	A	239	227	1.34
12	A	165	156	0.00
13	A	97	92	1.49
14	B	3217	3054	17.57
15	B	3202	3040	15.20
16	B	3091	2935	31.85
17	B	1502	1426	16.89
18	B	1477	1402	11.09
19	B	1392	1321	6.43
20	B	1007	956	22.08
21	B	995	945	3.40
22	B	734	696	1.50
23	B	269	255	1.30
24	B	178	169	0.46

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	1.037	-0.504
S2	0.000	-1.037	-0.504
C3	1.224	1.411	0.811
C4	-1.224	-1.411	0.811
H5	1.315	2.511	0.845
H6	0.879	1.045	1.792
H7	2.201	0.967	0.564
H8	-1.315	-2.511	0.845
H9	-0.879	-1.045	1.792
H10	-2.201	-0.967	0.564

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0743	1.8347	3.0363	2.3918	2.4585	2.4473	4.0173	3.2219	3.1626
S2	2.0743		3.0363	1.8347	4.0173	3.2219	3.1626	2.3918	2.4585	2.4473
C3	1.8347	3.0363		3.7354	1.1046	1.1023	1.1012	4.6720	3.3790	4.1768
C4	3.0363	1.8347	3.7354		4.6720	3.3790	4.1768	1.1046	1.1023	1.1012
H5	2.3918	4.0173	1.1046	4.6720		1.7987	1.8023	5.6690	4.2847	4.9536
H6	2.4585	3.2219	1.1023	3.3790	1.7987		1.8060	4.2847	2.7317	3.8789
H7	2.4473	3.1626	1.1012	4.1768	1.8023	1.8060		4.9536	3.8789	4.8082
H8	4.0173	2.3918	4.6720	1.1046	5.6690	4.2847	4.9536		1.7987	1.8023
H9	3.2219	2.4585	3.3790	1.1023	4.2847	2.7317	3.8789	1.7987		1.8060
H10	3.1626	2.4473	4.1768	1.1012	4.9536	3.8789	4.8082	1.8023	1.8060

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	101.751	S1	C3	H5	106.251
S1	C3	H6	111.205	S1	C3	H7	110.434
S2	S1	C3	101.751	S2	C4	H8	106.251
S2	C4	H9	111.205	S2	C4	H10	110.434
H5	C3	H6	109.183	H5	C3	H7	109.587
H6	C3	H7	110.094	H8	C4	H9	109.183
H8	C4	H10	109.587	H9	C4	H10	110.094

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

using model chemistry: MP2/CEP-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: MP2/CEP-31G*

States and conformations

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