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	hartrees
Energy at 0K	-870.556723
Energy at 298.15K	-870.562961
HF Energy	-870.125885
Nuclear repulsion energy	221.785278

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3192	3037	3.77
2	A	3174	3019	6.97
3	A	3091	2941	14.22
4	A	1579	1502	0.55
5	A	1567	1491	8.33
6	A	1458	1387	0.55
7	A	1050	998	5.48
8	A	1042	991	3.08
9	A	702	668	0.26
10	A	525	500	0.29
11	A	244	232	1.33
12	A	154	147	0.01
13	A	107	102	1.38
14	B	3192	3036	7.54
15	B	3173	3019	3.42
16	B	3090	2940	12.17
17	B	1583	1506	18.69
18	B	1561	1485	12.63
19	B	1450	1380	1.82
20	B	1050	999	20.34
21	B	1040	990	3.63
22	B	698	664	0.95
23	B	278	265	1.14
24	B	168	160	0.42

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	1.021	-0.509
S2	0.000	-1.021	-0.509
C3	1.203	1.401	0.819
C4	-1.203	-1.401	0.819
H5	1.296	2.492	0.858
H6	0.845	1.036	1.784
H7	2.173	0.958	0.587
H8	-1.296	-2.492	0.858
H9	-0.845	-1.036	1.784
H10	-2.173	-0.958	0.587

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0417	1.8318	3.0128	2.3902	2.4439	2.4350	3.9858	3.1942	3.1369
S2	2.0417		3.0128	1.8318	3.9858	3.1942	3.1369	2.3902	2.4439	2.4350
C3	1.8318	3.0128		3.6938	1.0950	1.0926	1.0916	4.6263	3.3266	4.1256
C4	3.0128	1.8318	3.6938		4.6263	3.3266	4.1256	1.0950	1.0926	1.0916
H5	2.3902	3.9858	1.0950	4.6263		1.7833	1.7875	5.6172	4.2291	4.9001
H6	2.4439	3.1942	1.0926	3.3266	1.7833		1.7900	4.2291	2.6736	3.8103
H7	2.4350	3.1369	1.0916	4.1256	1.7875	1.7900		4.9001	3.8103	4.7503
H8	3.9858	2.3902	4.6263	1.0950	5.6172	4.2291	4.9001		1.7833	1.7875
H9	3.1942	2.4439	3.3266	1.0926	4.2291	2.6736	3.8103	1.7833		1.7900
H10	3.1369	2.4350	4.1256	1.0916	4.9001	3.8103	4.7503	1.7875	1.7900

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	101.983	S1	C3	H5	106.780
S1	C3	H6	110.833	S1	C3	H7	110.216
S2	S1	C3	101.983	S2	C4	H8	106.780
S2	C4	H9	110.833	S2	C4	H10	110.216
H5	C3	H6	109.207	H5	C3	H7	109.663
H6	C3	H7	110.076	H8	C4	H9	109.207
H8	C4	H10	109.663	H9	C4	H10	110.076

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

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