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	hartrees
Energy at 0K	-553.159224
Energy at 298.15K	-553.166152
HF Energy	-552.480973
Nuclear repulsion energy	215.998828

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3270	3114	6.13
2	A	3243	3089	0.32
3	A	3185	3034	9.07
4	A	3144	2995	17.87
5	A	3100	2953	20.64
6	A	3058	2913	32.46
7	A	1622	1545	9.95
8	A	1477	1407	0.89
9	A	1459	1390	2.53
10	A	1343	1279	0.84
11	A	1322	1259	3.50
12	A	1274	1214	15.42
13	A	1200	1143	2.05
14	A	1146	1091	0.64
15	A	1107	1054	1.13
16	A	1032	983	3.33
17	A	1007	959	2.90
18	A	944	899	2.44
19	A	905	862	0.92
20	A	869	828	1.50
21	A	802	764	21.30
22	A	697	664	5.95
23	A	686	654	28.01
24	A	651	620	19.56
25	A	495	472	0.48
26	A	404	385	2.48
27	A	194	185	1.02

Atom	x (Å)	y (Å)	z (Å)
C1	-0.069	-1.249	0.241
H2	-0.081	-1.440	1.328
H3	0.144	-2.189	-0.292
C4	-1.379	-0.580	-0.201
H5	-2.240	-1.011	0.338
H6	-1.548	-0.738	-1.286
C7	0.108	1.280	0.090
H8	0.476	2.306	0.188
C9	-1.189	0.898	0.067
H10	-2.020	1.606	0.138
S11	1.278	-0.039	-0.100

	C1	H2	H3	C4	H5	H6	C7	H8	C9	H10	S11
C1		1.1040	1.1008	1.5362	2.1859	2.1862	2.5403	3.5968	2.4281	3.4597	1.8426
H2	1.1040		1.7984	2.1828	2.4136	3.0786	2.9951	3.9551	2.8785	3.8023	2.4187
H3	1.1008	1.7984		2.2176	2.7329	2.4409	3.4903	4.5321	3.3817	4.3898	2.4379
C4	1.5362	2.1828	2.2176		1.1031	1.1087	2.3998	3.4524	1.5142	2.3032	2.7137
H5	2.1859	2.4136	2.7329	1.1031		1.7856	3.2900	4.2889	2.1954	2.6335	3.6758
H6	2.1862	3.0786	2.4409	1.1087	1.7856		2.9515	3.9410	2.1531	2.7826	3.1437
C7	2.5403	2.9951	3.4903	2.3998	3.2900	2.9515		1.0935	1.3531	2.1538	1.7735
H8	3.5968	3.9551	4.5321	3.4524	4.2889	3.9410	1.0935		2.1837	2.5925	2.4950
C9	2.4281	2.8785	3.3817	1.5142	2.1954	2.1531	1.3531	2.1837		1.0938	2.6447
H10	3.4597	3.8023	4.3898	2.3032	2.6335	2.7826	2.1538	2.5925	1.0938		3.6934
S11	1.8426	2.4187	2.4379	2.7137	3.6758	3.1437	1.7735	2.4950	2.6447	3.6934

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	110.766	C1	C4	H6	110.459
C1	C4	C9	105.499	C1	S11	C7	89.231
H2	C1	H3	109.308	H2	C1	C4	110.466
H2	C1	S11	107.683	H3	C1	C4	113.451
H3	C1	S11	109.228	C4	C1	S11	106.512
C4	C9	C7	113.519	C4	C9	H10	123.234
H5	C4	H6	107.664	H5	C4	C9	113.087
H6	C4	C9	109.377	C7	C9	H10	122.986
H8	C7	C9	126.057	H8	C7	S11	119.056
C9	C7	S11	114.868

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

using model chemistry: MP2/cc-pVDZ

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/cc-pVDZ

States and conformations

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