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	hartrees
Energy at 0K	-35.955783
Energy at 298.15K	-35.962491
HF Energy	-35.353209
Nuclear repulsion energy	85.464199

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3233	3069	19.21
2	A₁	3098	2941	0.09
3	A₁	1695	1609	7.29
4	A₁	1520	1443	5.46
5	A₁	1327	1260	1.31
6	A₁	1132	1075	0.12
7	A₁	979	930	0.19
8	A₁	740	703	2.96
9	A₁	516	490	0.11
10	A₂	3162	3002	0.00
11	A₂	1159	1100	0.00
12	A₂	984	935	0.00
13	A₂	924	877	0.00
14	A₂	348	330	0.00
15	B₁	3164	3004	33.20
16	B₁	1147	1089	17.03
17	B₁	930	883	0.62
18	B₁	684	650	74.07
19	B₁	80	76	5.00
20	B₂	3197	3035	3.62
21	B₂	3099	2942	74.26
22	B₂	1514	1438	0.05
23	B₂	1359	1290	1.99
24	B₂	1283	1218	12.00
25	B₂	998	948	6.40
26	B₂	825	783	1.07
27	B₂	662	628	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	1.256
C2	0.000	1.363	0.009
C3	0.000	-1.363	0.009
C4	0.000	0.684	-1.353
C5	0.000	-0.684	-1.353
H6	-0.897	1.994	0.141
H7	0.897	1.994	0.141
H8	0.897	-1.994	0.141
H9	-0.897	-1.994	0.141
H10	0.000	1.285	-2.270
H11	0.000	-1.285	-2.270

	S1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11
S1		1.8474	1.8474	2.6971	2.6971	2.4541	2.4541	2.4541	2.4541	3.7532	3.7532
C2	1.8474		2.7253	1.5214	2.4580	1.1049	1.1049	3.4768	3.4768	2.2803	3.4934
C3	1.8474	2.7253		2.4580	1.5214	3.4768	3.4768	1.1049	1.1049	3.4934	2.2803
C4	2.6971	1.5214	2.4580		1.3677	2.1802	2.1802	3.1948	3.1948	1.0968	2.1721
C5	2.6971	2.4580	1.5214	1.3677		3.1948	3.1948	2.1802	2.1802	2.1721	1.0968
H6	2.4541	1.1049	3.4768	2.1802	3.1948		1.7942	4.3726	3.9875	2.6689	4.1678
H7	2.4541	1.1049	3.4768	2.1802	3.1948	1.7942		3.9875	4.3726	2.6689	4.1678
H8	2.4541	3.4768	1.1049	3.1948	2.1802	4.3726	3.9875		1.7942	4.1678	2.6689
H9	2.4541	3.4768	1.1049	3.1948	2.1802	3.9875	4.3726	1.7942		4.1678	2.6689
H10	3.7532	2.2803	3.4934	1.0968	2.1721	2.6689	2.6689	4.1678	4.1678		2.5700
H11	3.7532	3.4934	2.2803	2.1721	1.0968	4.1678	4.1678	2.6689	2.6689	2.5700

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	C4	105.973	S1	C2	H6	109.895
S1	C2	H7	109.895	S1	C3	C5	105.973
S1	C3	H8	109.895	S1	C3	H9	109.895
C2	S1	C3	95.056	C2	C4	C5	116.499
C2	C4	H10	120.264	C3	C5	C4	116.499
C3	C5	H11	120.264	C4	C2	H6	111.240
C4	C2	H7	111.240	C4	C5	H11	123.237
C5	C3	H8	111.240	C5	C3	H9	111.240
C5	C4	H10	123.237	H6	C2	H7	108.579
H8	C3	H9	108.579

All results from a given calculation for C₄H₆S (Thiophene, 2,5-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, 2,5-dihydro-)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for C₄H₆S (Thiophene, 2,5-dihydro-)