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	hartrees
Energy at 0K	-233.696029
Energy at 298.15K	-233.707852
HF Energy	-233.019413
Nuclear repulsion energy	237.791364

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3297	3046	41.82
2	A	3204	2960	48.11
3	A	3184	2941	1.26
4	A	3157	2916	19.10
5	A	3141	2901	0.36
6	A	1843	1703	1.49
7	A	1607	1484	1.00
8	A	1581	1460	0.20
9	A	1481	1368	0.16
10	A	1475	1363	0.13
11	A	1347	1244	0.81
12	A	1325	1224	0.08
13	A	1234	1140	0.06
14	A	1172	1083	0.04
15	A	1142	1055	0.08
16	A	1061	980	0.00
17	A	966	892	0.88
18	A	881	814	0.36
19	A	871	804	0.61
20	A	523	483	0.01
21	A	422	390	0.01
22	A	294	271	0.05
23	B	3273	3023	8.89
24	B	3210	2965	64.40
25	B	3183	2940	77.17
26	B	3157	2916	16.93
27	B	3140	2901	64.54
28	B	1594	1473	3.79
29	B	1589	1468	5.14
30	B	1510	1394	0.09
31	B	1477	1364	2.21
32	B	1436	1326	1.24
33	B	1368	1264	2.44
34	B	1231	1137	5.51
35	B	1111	1026	2.68
36	B	1077	995	1.27
37	B	996	920	4.99
38	B	940	868	3.83
39	B	776	717	12.80
40	B	693	640	20.12
41	B	476	440	0.95
42	B	177	163	0.16

Atom	x (Å)	y (Å)	z (Å)
C1	-0.006	-0.663	1.297
C2	0.006	0.663	1.297
C3	0.000	1.494	0.043
C4	0.000	-1.494	0.043
C5	-0.376	0.663	-1.181
C6	0.376	-0.663	-1.181
H7	-0.022	-1.195	2.240
H8	0.022	1.195	2.240
H9	0.986	1.945	-0.099
H10	-0.986	-1.945	-0.099
H11	-0.694	2.328	0.159
H12	0.694	-2.328	0.159
H13	-1.449	0.466	-1.166
H14	1.449	-0.466	-1.166
H15	-0.170	1.223	-2.093
H16	0.170	-1.223	-2.093

	C1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		1.3269	2.4954	1.5041	2.8354	2.5075	1.0827	2.0843	3.1203	2.1335	3.2738	2.1345	3.0705	2.8681	3.8837	3.4411
C2	1.3269		1.5041	2.4954	2.5075	2.8354	2.0843	1.0827	2.1335	3.1203	2.1345	3.2738	2.8681	3.0705	3.4411	3.8837
C3	2.4954	1.5041		2.9879	1.5264	2.5089	3.4725	2.2173	1.0937	3.5803	1.0913	3.8864	2.1496	2.7211	2.1604	3.4610
C4	1.5041	2.4954	2.9879		2.5089	1.5264	2.2173	3.4725	3.5803	1.0937	3.8864	1.0913	2.7211	2.1496	3.4610	2.1604
C5	2.8354	2.5075	1.5264	2.5089		1.5247	3.9096	3.4851	2.1606	2.8892	2.1609	3.4483	1.0918	2.1459	1.0900	2.1656
C6	2.5075	2.8354	2.5089	1.5264	1.5247		3.4851	3.9096	2.8892	2.1606	3.4483	2.1609	2.1459	1.0918	2.1656	1.0900
H7	1.0827	2.0843	3.4725	2.2173	3.9096	3.4851		2.3908	4.0431	2.6387	4.1468	2.4751	4.0499	3.7817	4.9650	4.3379
H8	2.0843	1.0827	2.2173	3.4725	3.4851	3.9096	2.3908		2.6387	4.0431	2.4751	4.1468	3.7817	4.0499	4.3379	4.9650
H9	3.1203	2.1335	1.0937	3.5803	2.1606	2.8892	4.0431	2.6387		4.3613	1.7426	4.2908	3.0429	2.6769	2.4157	3.8319
H10	2.1335	3.1203	3.5803	1.0937	2.8892	2.1606	2.6387	4.0431	4.3613		4.2908	1.7426	2.6769	3.0429	3.8319	2.4157
H11	3.2738	2.1345	1.0913	3.8864	2.1609	3.4483	4.1468	2.4751	1.7426	4.2908		4.8588	2.4076	3.7626	2.5632	4.2936
H12	2.1345	3.2738	3.8864	1.0913	3.4483	2.1609	2.4751	4.1468	4.2908	1.7426	4.8588		3.7626	2.4076	4.2936	2.5632
H13	3.0705	2.8681	2.1496	2.7211	1.0918	2.1459	4.0499	3.7817	3.0429	2.6769	2.4076	3.7626		3.0444	1.7521	2.5167
H14	2.8681	3.0705	2.7211	2.1496	2.1459	1.0918	3.7817	4.0499	2.6769	3.0429	3.7626	2.4076	3.0444		2.5167	1.7521
H15	3.8837	3.4411	2.1604	3.4610	1.0900	2.1656	4.9650	4.3379	2.4157	3.8319	2.5632	4.2936	1.7521	2.5167		2.4703
H16	3.4411	3.8837	3.4610	2.1604	2.1656	1.0900	4.3379	4.9650	3.8319	2.4157	4.2936	2.5632	2.5167	1.7521	2.4703

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.513	C1	C2	H8	119.423
C1	C4	C6	111.671	C1	C4	H10	109.414
C1	C4	H12	109.628	C2	C1	C4	123.513
C2	C1	H7	119.423	C2	C3	C5	111.671
C2	C3	H9	109.414	C2	C3	H11	109.628
C3	C2	H8	117.064	C3	C5	C6	110.629
C3	C5	H13	109.247	C3	C5	H15	110.207
C4	C1	H7	117.064	C4	C6	C5	110.629
C4	C6	H14	109.247	C4	C6	H16	110.207
C5	C3	H9	110.001	C5	C3	H11	110.170
C5	C6	H14	109.080	C5	C6	H16	110.739
C6	C4	H10	110.001	C6	C4	H12	110.170
C6	C5	H13	109.080	C6	C5	H15	110.739
H9	C3	H11	105.786	H10	C4	H12	105.786
H13	C5	H15	106.847	H14	C6	H16	106.847

All results from a given calculation for C₆H₁₀ (cyclohexene)

using model chemistry: CID/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 C6H10 (cyclohexene)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for C₆H₁₀ (cyclohexene)