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	hartrees
Energy at 0K	-233.422093
Energy at 298.15K	-233.433900
Nuclear repulsion energy	235.600092

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3249	3038	50.47
2	A	3146	2942	55.40
3	A	3127	2924	1.53
4	A	3099	2898	17.89
5	A	3085	2885	1.31
6	A	1803	1687	1.21
7	A	1603	1500	1.21
8	A	1587	1484	0.43
9	A	1473	1377	0.06
10	A	1448	1354	0.40
11	A	1342	1255	0.64
12	A	1323	1237	0.02
13	A	1231	1151	0.12
14	A	1180	1104	0.08
15	A	1134	1060	0.11
16	A	1056	988	0.00
17	A	947	886	1.32
18	A	880	823	0.82
19	A	854	799	0.13
20	A	526	492	0.02
21	A	420	393	0.00
22	A	286	267	0.05
23	B	3219	3010	10.76
24	B	3152	2948	76.97
25	B	3124	2922	83.56
26	B	3098	2897	15.90
27	B	3084	2884	67.40
28	B	1597	1494	5.92
29	B	1593	1490	4.40
30	B	1505	1407	0.05
31	B	1456	1361	0.50
32	B	1451	1357	2.99
33	B	1359	1271	1.79
34	B	1233	1153	5.43
35	B	1111	1039	1.19
36	B	1080	1010	1.29
37	B	1003	938	5.28
38	B	917	858	4.17
39	B	777	727	13.61
40	B	696	651	24.75
41	B	478	447	1.01
42	B	167	156	0.16

Atom	x (Å)	y (Å)	z (Å)
C1	-0.006	-0.670	1.311
C2	0.006	0.670	1.311
C3	0.000	1.510	0.046
C4	0.000	-1.510	0.046
C5	-0.377	0.672	-1.194
C6	0.377	-0.672	-1.194
H7	-0.022	-1.208	2.255
H8	0.022	1.208	2.255
H9	0.989	1.966	-0.100
H10	-0.989	-1.966	-0.100
H11	-0.704	2.343	0.161
H12	0.704	-2.343	0.161
H13	-1.457	0.476	-1.183
H14	1.457	-0.476	-1.183
H15	-0.163	1.234	-2.109
H16	0.163	-1.234	-2.109

	C1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		1.3398	2.5204	1.5183	2.8657	2.5339	1.0867	2.1019	3.1509	2.1531	3.2995	2.1507	3.1043	2.8979	3.9173	3.4702
C2	1.3398		1.5183	2.5204	2.5339	2.8657	2.1019	1.0867	2.1531	3.1509	2.1507	3.2995	2.8979	3.1043	3.4702	3.9173
C3	2.5204	1.5183		3.0209	1.5439	2.5387	3.5024	2.2291	1.0990	3.6173	1.0966	3.9193	2.1689	2.7533	2.1792	3.4938
C4	1.5183	2.5204	3.0209		2.5387	1.5439	2.2291	3.5024	3.6173	1.0990	3.9193	1.0966	2.7533	2.1689	3.4938	2.1792
C5	2.8657	2.5339	1.5439	2.5387		1.5418	3.9439	3.5129	2.1768	2.9207	2.1765	3.4786	1.0972	2.1641	1.0953	2.1827
C6	2.5339	2.8657	2.5387	1.5439	1.5418		3.5129	3.9439	2.9207	2.1768	3.4786	2.1765	2.1641	1.0972	2.1827	1.0953
H7	1.0867	2.1019	3.5024	2.2291	3.9439	3.5129		2.4163	4.0793	2.6560	4.1783	2.4896	4.0882	3.8134	5.0027	4.3678
H8	2.1019	1.0867	2.2291	3.5024	3.5129	3.9439	2.4163		2.6560	4.0793	2.4896	4.1783	3.8134	4.0882	4.3678	5.0027
H9	3.1509	2.1531	1.0990	3.6173	2.1768	2.9207	4.0793	2.6560		4.4015	1.7546	4.3265	3.0622	2.7120	2.4288	3.8679
H10	2.1531	3.1509	3.6173	1.0990	2.9207	2.1768	2.6560	4.0793	4.4015		4.3265	1.7546	2.7120	3.0622	3.8679	2.4288
H11	3.2995	2.1507	1.0966	3.9193	2.1765	3.4786	4.1783	2.4896	1.7546	4.3265		4.8937	2.4211	3.7983	2.5844	4.3252
H12	2.1507	3.2995	3.9193	1.0966	3.4786	2.1765	2.4896	4.1783	4.3265	1.7546	4.8937		3.7983	2.4211	4.3252	2.5844
H13	3.1043	2.8979	2.1689	2.7533	1.0972	2.1641	4.0882	3.8134	3.0622	2.7120	2.4211	3.7983		3.0655	1.7627	2.5311
H14	2.8979	3.1043	2.7533	2.1689	2.1641	1.0972	3.8134	4.0882	2.7120	3.0622	3.7983	2.4211	3.0655		2.5311	1.7627
H15	3.9173	3.4702	2.1792	3.4938	1.0953	2.1827	5.0027	4.3678	2.4288	3.8679	2.5844	4.3252	1.7627	2.5311		2.4900
H16	3.4702	3.9173	3.4938	2.1792	2.1827	1.0953	4.3678	5.0027	3.8679	2.4288	4.3252	2.5844	2.5311	1.7627	2.4900

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.614	C1	C2	H8	119.686
C1	C4	C6	111.679	C1	C4	H10	109.663
C1	C4	H12	109.616	C2	C1	C4	123.614
C2	C1	H7	119.686	C2	C3	C5	111.679
C2	C3	H9	109.663	C2	C3	H11	109.616
C3	C2	H8	116.700	C3	C5	C6	110.719
C3	C5	H13	109.243	C3	C5	H15	110.161
C4	C1	H7	116.700	C4	C6	C5	110.719
C4	C6	H14	109.243	C4	C6	H16	110.161
C5	C3	H9	109.760	C5	C3	H11	109.870
C5	C6	H14	109.018	C5	C6	H16	110.584
C6	C4	H10	109.760	C6	C4	H12	109.870
C6	C5	H13	109.018	C6	C5	H15	110.584
H9	C3	H11	106.098	H10	C4	H12	106.098
H13	C5	H15	107.027	H14	C6	H16	107.027

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)