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	hartrees
Energy at 0K	-24.770481
Energy at 298.15K
HF Energy	-24.399406
Nuclear repulsion energy	43.457543

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3206	3044	20.99	93.02	0.72	0.84
2	A₁	3084	2928	39.03	256.19	0.01	0.01
3	A₁	1514	1437	0.21	22.92	0.74	0.85
4	A₁	1416	1345	1.98	0.95	0.32	0.48
5	A₁	1081	1026	20.95	12.69	0.59	0.74
6	A₁	731	694	3.42	23.55	0.14	0.24
7	A₁	267	253	0.12	2.46	0.65	0.79
8	A₂	3194	3032	0.00	6.29	0.75	0.86
9	A₂	1487	1412	0.00	33.00	0.75	0.86
10	A₂	983	934	0.00	16.43	0.75	0.86
11	A₂	168	159	0.00	0.66	0.75	0.86
12	B₁	3187	3026	53.36	98.91	0.75	0.86
13	B₁	1496	1420	17.52	0.16	0.75	0.86
14	B₁	1020	968	10.50	6.62	0.75	0.86
15	B₁	193	183	1.23	0.36	0.75	0.86
16	B₂	3207	3044	7.48	45.00	0.75	0.86
17	B₂	3089	2932	39.94	0.42	0.75	0.86
18	B₂	1506	1430	16.36	0.18	0.75	0.86
19	B₂	1390	1320	4.73	4.10	0.75	0.86
20	B₂	940	893	0.23	2.47	0.75	0.86
21	B₂	786	746	0.19	13.47	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.673
C2	0.000	1.380	-0.522
C3	0.000	-1.380	-0.522
H4	0.000	2.317	0.060
H5	0.000	-2.317	0.060
H6	0.902	1.353	-1.157
H7	-0.902	1.353	-1.157
H8	-0.902	-1.353	-1.157
H9	0.902	-1.353	-1.157

	S1	C2	C3	H4	H5	H6	H7	H8	H9
S1		1.8259	1.8259	2.3964	2.3964	2.4487	2.4487	2.4487	2.4487
C2	1.8259		2.7605	1.1025	3.7424	1.1038	1.1038	2.9479	2.9479
C3	1.8259	2.7605		3.7424	1.1025	2.9479	2.9479	1.1038	1.1038
H4	2.3964	1.1025	3.7424		4.6332	1.7955	1.7955	3.9705	3.9705
H5	2.3964	3.7424	1.1025	4.6332		3.9705	3.9705	1.7955	1.7955
H6	2.4487	1.1038	2.9479	1.7955	3.9705		1.8047	3.2532	2.7067
H7	2.4487	1.1038	2.9479	1.7955	3.9705	1.8047		2.7067	3.2532
H8	2.4487	2.9479	1.1038	3.9705	1.7955	3.2532	2.7067		1.8047
H9	2.4487	2.9479	1.1038	3.9705	1.7955	2.7067	3.2532	1.8047

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	H4	107.239	S1	C2	H6	110.994
S1	C2	H7	110.994	S1	C3	H5	107.239
S1	C3	H8	110.994	S1	C3	H9	110.994
C2	S1	C3	98.216	H4	C2	H6	108.936
H4	C2	H7	108.936	H5	C3	H8	108.936
H5	C3	H9	108.936	H6	C2	H7	109.670
H8	C3	H9	109.670

All results from a given calculation for CH₃SCH₃ (Dimethyl sulfide)

using model chemistry: MP2/CEP-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 CH3SCH3 (Dimethyl sulfide)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for CH₃SCH₃ (Dimethyl sulfide)