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	hartrees
Energy at 0K	-35.957998
Energy at 298.15K	-35.964916
HF Energy	-35.352144
Nuclear repulsion energy	86.194537

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3259	3094	11.06
2	A	3224	3061	0.61
3	A	3201	3039	19.33
4	A	3159	2999	23.32
5	A	3114	2957	30.70
6	A	3078	2923	39.42
7	A	1619	1537	11.87
8	A	1518	1441	0.79
9	A	1498	1422	2.92
10	A	1363	1294	1.18
11	A	1347	1279	5.24
12	A	1290	1225	17.51
13	A	1224	1162	1.85
14	A	1165	1106	0.48
15	A	1114	1058	1.58
16	A	1043	990	5.96
17	A	1022	970	3.77
18	A	943	895	3.58
19	A	894	849	0.42
20	A	879	834	1.96
21	A	811	770	27.59
22	A	709	673	7.26
23	A	695	659	58.14
24	A	654	621	23.77
25	A	496	471	0.61
26	A	401	380	3.11
27	A	199	189	1.10

Atom	x (Å)	y (Å)	z (Å)
C1	-0.071	-1.255	0.248
H2	-0.087	-1.445	1.335
H3	0.140	-2.192	-0.293
C4	-1.390	-0.582	-0.207
H5	-2.249	-1.008	0.343
H6	-1.557	-0.743	-1.291
C7	0.120	1.290	0.089
H8	0.496	2.313	0.193
C9	-1.197	0.908	0.068
H10	-2.027	1.618	0.147
S11	1.282	-0.044	-0.101

	C1	H2	H3	C4	H5	H6	C7	H8	C9	H10	S11
C1		1.1040	1.1028	1.5499	2.1944	2.1999	2.5575	3.6129	2.4450	3.4770	1.8488
H2	1.1040		1.8061	2.1966	2.4189	3.0907	3.0135	3.9710	2.8938	3.8156	2.4293
H3	1.1028	1.8061		2.2234	2.7417	2.4444	3.5038	4.5452	3.3955	4.4053	2.4403
C4	1.5499	2.1966	2.2234		1.1050	1.1082	2.4240	3.4784	1.5274	2.3173	2.7282
H5	2.1944	2.4189	2.7417	1.1050		1.7944	3.3102	4.3106	2.2023	2.6422	3.6870
H6	2.1999	3.0907	2.4444	1.1082	1.7944		2.9751	3.9691	2.1687	2.8042	3.1563
C7	2.5575	3.0135	3.5038	2.4240	3.3102	2.9751		1.0942	1.3716	2.1720	1.7800
H8	3.6129	3.9710	4.5452	3.4784	4.3106	3.9691	1.0942		2.2036	2.6168	2.5020
C9	2.4450	2.8938	3.3955	1.5274	2.2023	2.1687	1.3716	2.2036		1.0948	2.6610
H10	3.4770	3.8156	4.4053	2.3173	2.6422	2.8042	2.1720	2.6168	1.0948		3.7110
S11	1.8488	2.4293	2.4403	2.7282	3.6870	3.1563	1.7800	2.5020	2.6610	3.7110

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	110.368	C1	C4	H6	110.607
C1	C4	C9	105.218	C1	S11	C7	89.605
H2	C1	H3	109.856	H2	C1	C4	110.597
H2	C1	S11	108.052	H3	C1	C4	112.805
H3	C1	S11	108.903	C4	C1	S11	106.453
C4	C9	C7	113.363	C4	C9	H10	123.346
H5	C4	H6	108.344	H5	C4	C9	112.583
H6	C4	C9	109.717	C7	C9	H10	123.046
H8	C7	C9	126.309	H8	C7	S11	119.101
C9	C7	S11	114.583

All results from a given calculation for C₄H₆S (Thiophene, 2,3-dihydro-)

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 C4H6S (Thiophene, 2,3-dihydro-)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for C₄H₆S (Thiophene, 2,3-dihydro-)