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	hartrees
Energy at 0K	-874.784330
Energy at 298.15K	-874.790575
HF Energy	-874.247185
Nuclear repulsion energy	222.156508

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3233	3046	3.30
2	A	3218	3032	6.48
3	A	3119	2939	15.42
4	A	1540	1451	0.65
5	A	1526	1438	7.32
6	A	1437	1354	1.33
7	A	1035	975	5.86
8	A	1027	967	2.83
9	A	751	708	0.10
10	A	531	500	0.19
11	A	242	228	1.59
12	A	159	150	0.00
13	A	100	94	1.34
14	B	3233	3046	6.21
15	B	3218	3032	3.00
16	B	3118	2937	13.85
17	B	1544	1455	18.72
18	B	1519	1431	11.04
19	B	1429	1347	2.90
20	B	1033	973	20.15
21	B	1026	966	3.41
22	B	747	703	1.56
23	B	272	256	1.37
24	B	173	163	0.42

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	1.027	-0.501
S2	0.000	-1.027	-0.501
C3	1.198	1.407	0.804
C4	-1.198	-1.407	0.804
H5	1.289	2.495	0.839
H6	0.854	1.052	1.777
H7	2.171	0.972	0.575
H8	-1.289	-2.495	0.839
H9	-0.854	-1.052	1.777
H10	-2.171	-0.972	0.575

	S1	S2	C3	C4	H5	H6	H7	H8	H9	H10
S1		2.0537	1.8119	3.0102	2.3694	2.4334	2.4237	3.9829	3.2007	3.1413
S2	2.0537		3.0102	1.8119	3.9829	3.2007	3.1413	2.3694	2.4334	2.4237
C3	1.8119	3.0102		3.6954	1.0930	1.0910	1.0902	4.6276	3.3476	4.1306
C4	3.0102	1.8119	3.6954		4.6276	3.3476	4.1306	1.0930	1.0910	1.0902
H5	2.3694	3.9829	1.0930	4.6276		1.7754	1.7797	5.6175	4.2501	4.9058
H6	2.4334	3.2007	1.0910	3.3476	1.7754		1.7848	4.2501	2.7112	3.8338
H7	2.4237	3.1413	1.0902	4.1306	1.7797	1.7848		4.9058	3.8338	4.7576
H8	3.9829	2.3694	4.6276	1.0930	5.6175	4.2501	4.9058		1.7754	1.7797
H9	3.2007	2.4334	3.3476	1.0910	4.2501	2.7112	3.8338	1.7754		1.7848
H10	3.1413	2.4237	4.1306	1.0902	4.9058	3.8338	4.7576	1.7797	1.7848

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	S2	C4	102.105	S1	C3	H5	106.674
S1	C3	H6	111.486	S1	C3	H7	110.799
S2	S1	C3	102.105	S2	C4	H8	106.674
S2	C4	H9	111.486	S2	C4	H10	110.799
H5	C3	H6	108.761	H5	C3	H7	109.216
H6	C3	H7	109.814	H8	C4	H9	108.761
H8	C4	H10	109.216	H9	C4	H10	109.814

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

using model chemistry: MP2=FULL/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: MP2=FULL/6-31G*

States and conformations

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