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	hartrees
Energy at 0K	-874.798863
Energy at 298.15K	-874.805088
HF Energy	-874.247108
Nuclear repulsion energy	221.401534

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3224	3026	3.56
2	A	3209	3012	7.61
3	A	3120	2929	17.35
4	A	1538	1443	0.49
5	A	1524	1430	7.50
6	A	1438	1350	1.19
7	A	1033	970	5.48
8	A	1027	964	2.73
9	A	749	703	0.12
10	A	524	492	0.14
11	A	241	226	1.55
12	A	158	148	0.00
13	A	98	92	1.33
14	B	3224	3026	8.59
15	B	3209	3012	5.05
16	B	3119	2927	15.00
17	B	1541	1447	18.37
18	B	1517	1424	10.65
19	B	1431	1343	2.92
20	B	1033	969	18.51
21	B	1024	962	3.11
22	B	744	699	1.24
23	B	272	255	1.31
24	B	169	159	0.41

Atom	x (Å)	y (Å)	z (Å)
S1	-0.456	0.926	-0.503
S2	0.456	-0.926	-0.503
C3	0.456	1.796	0.807
C4	-0.456	-1.796	0.807
H5	0.054	2.812	0.847
H6	0.307	1.321	1.779
H7	1.521	1.839	0.575
H8	-0.054	-2.812	0.847
H9	-0.307	-1.321	1.779
H10	-1.521	-1.839	0.575

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0643	1.8177	3.0210	2.3746	2.4376	2.4291	3.9946	3.2055	3.1526
S2	2.0643		3.0210	1.8177	3.9946	3.2055	3.1526	2.3746	2.4376	2.4291
C3	1.8177	3.0210		3.7060	1.0932	1.0916	1.0906	4.6365	3.3525	4.1436
C4	3.0210	1.8177	3.7060		4.6365	3.3525	4.1436	1.0932	1.0916	1.0906
H5	2.3746	3.9946	1.0932	4.6365		1.7767	1.7809	5.6253	4.2520	4.9176
H6	2.4376	3.2055	1.0916	3.3525	1.7767		1.7858	4.2520	2.7118	3.8429
H7	2.4291	3.1526	1.0906	4.1436	1.7809	1.7858		4.9176	3.8429	4.7717
H8	3.9946	2.3746	4.6365	1.0932	5.6253	4.2520	4.9176		1.7767	1.7809
H9	3.2055	2.4376	3.3525	1.0916	4.2520	2.7118	3.8429	1.7767		1.7858
H10	3.1526	2.4291	4.1436	1.0906	4.9176	3.8429	4.7717	1.7809	1.7858

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	102.005	S1	C3	H5	106.657
S1	C3	H6	111.375	S1	C3	H7	110.788
S2	S1	C3	102.005	S2	C4	H8	106.657
S2	C4	H9	111.375	S2	C4	H10	110.788
H5	C3	H6	108.819	H5	C3	H7	109.271
H6	C3	H7	109.842	H8	C4	H9	108.819
H8	C4	H10	109.271	H9	C4	H10	109.842

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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