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	hartrees
Energy at 0K	-875.119204
Energy at 298.15K	-875.125521
HF Energy	-874.305793
Nuclear repulsion energy	222.558564

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3202	3033	3.47
2	A	3188	3019	6.96
3	A	3091	2927	21.15
4	A	1510	1430	0.70
5	A	1504	1425	9.31
6	A	1427	1351	0.74
7	A	1030	975	8.53
8	A	1018	964	2.65
9	A	748	708	0.14
10	A	510	483	0.25
11	A	247	234	1.62
12	A	178	169	0.13
13	A	103	97	1.12
14	B	3201	3032	7.92
15	B	3188	3019	5.14
16	B	3089	2926	18.58
17	B	1516	1436	22.16
18	B	1495	1416	13.53
19	B	1418	1343	1.27
20	B	1025	971	24.25
21	B	1021	967	6.59
22	B	745	706	1.98
23	B	276	261	1.70
24	B	193	183	0.41

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	1.032	-0.506
S2	0.000	-1.032	-0.506
C3	1.189	1.375	0.812
C4	-1.189	-1.375	0.812
H5	1.293	2.460	0.873
H6	0.837	1.003	1.774
H7	2.157	0.935	0.580
H8	-1.293	-2.460	0.873
H9	-0.837	-1.003	1.774
H10	-2.157	-0.935	0.580

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0643	1.8072	2.9902	2.3686	2.4285	2.4174	3.9705	3.1684	3.1148
S2	2.0643		2.9902	1.8072	3.9705	3.1684	3.1148	2.3686	2.4285	2.4174
C3	1.8072	2.9902		3.6345	1.0917	1.0897	1.0888	4.5676	3.2681	4.0719
C4	2.9902	1.8072	3.6345		4.5676	3.2681	4.0719	1.0917	1.0897	1.0888
H5	2.3686	3.9705	1.0917	4.5676		1.7725	1.7772	5.5575	4.1638	4.8486
H6	2.4285	3.1684	1.0897	3.2681	1.7725		1.7811	4.1638	2.6123	3.7605
H7	2.4174	3.1148	1.0888	4.0719	1.7772	1.7811		4.8486	3.7605	4.7019
H8	3.9705	2.3686	4.5676	1.0917	5.5575	4.1638	4.8486		1.7725	1.7772
H9	3.1684	2.4285	3.2681	1.0897	4.1638	2.6123	3.7605	1.7725		1.7811
H10	3.1148	2.4174	4.0719	1.0888	4.8486	3.7605	4.7019	1.7772	1.7811

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	100.926	S1	C3	H5	106.979
S1	C3	H6	111.511	S1	C3	H7	110.715
S2	S1	C3	100.926	S2	C4	H8	106.979
S2	C4	H9	111.511	S2	C4	H10	110.715
H5	C3	H6	108.689	H5	C3	H7	109.183
H6	C3	H7	109.682	H8	C4	H9	108.689
H8	C4	H10	109.183	H9	C4	H10	109.682

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

using model chemistry: MP2=FULL/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: MP2=FULL/6-311G*

States and conformations

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