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	hartrees
Energy at 0K	-875.069196
Energy at 298.15K
Nuclear repulsion energy	223.473277

Atom	x (Å)	y (Å)	z (Å)
S1	-0.451	0.911	-0.500
S2	0.451	-0.911	-0.500
C3	0.451	1.781	0.804
C4	-0.451	-1.781	0.804
H5	0.045	2.791	0.840
H6	0.299	1.302	1.768
H7	1.510	1.822	0.567
H8	-0.045	-2.791	0.840
H9	-0.299	-1.302	1.768
H10	-1.510	-1.822	0.567

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0339	1.8085	2.9912	2.3611	2.4206	2.4114	3.9581	3.1729	3.1194
S2	2.0339		2.9912	1.8085	3.9581	3.1729	3.1194	2.3611	2.4206	2.4114
C3	1.8085	2.9912		3.6737	1.0894	1.0867	1.0860	4.5983	3.3160	4.1086
C4	2.9912	1.8085	3.6737		4.5983	3.3160	4.1086	1.0894	1.0867	1.0860
H5	2.3611	3.9581	1.0894	4.5983		1.7722	1.7776	5.5822	4.2110	4.8754
H6	2.4206	3.1729	1.0867	3.3160	1.7722		1.7829	4.2110	2.6724	3.8047
H7	2.4114	3.1194	1.0860	4.1086	1.7776	1.7829		4.8754	3.8047	4.7329
H8	3.9581	2.3611	4.5983	1.0894	5.5822	4.2110	4.8754		1.7722	1.7776
H9	3.1729	2.4206	3.3160	1.0867	4.2110	2.6724	3.8047	1.7722		1.7829
H10	3.1194	2.4114	4.1086	1.0860	4.8754	3.8047	4.7329	1.7776	1.7829

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	102.084	S1	C3	H5	106.476
S1	C3	H6	110.992	S1	C3	H7	110.336
S2	S1	C3	102.084	S2	C4	H8	106.476
S2	C4	H9	110.992	S2	C4	H10	110.336
H5	C3	H6	109.056	H5	C3	H7	109.603
H6	C3	H7	110.292	H8	C4	H9	109.056
H8	C4	H10	109.603	H9	C4	H10	110.292

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

using model chemistry: MP2/cc-pV(T+d)Z

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/cc-pV(T+d)Z

States and conformations

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