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	hartrees
Energy at 0K	-233.903176
Energy at 298.15K	-233.914850
HF Energy	-233.034610
Nuclear repulsion energy	237.732680

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3255	3041	38.89
2	A	3180	2972	33.92
3	A	3156	2949	0.51
4	A	3120	2916	22.63
5	A	3102	2898	0.02
6	A	1743	1629	1.83
7	A	1556	1454	0.78
8	A	1531	1431	0.06
9	A	1428	1334	0.39
10	A	1423	1329	0.13
11	A	1305	1220	0.81
12	A	1284	1199	0.07
13	A	1189	1111	0.05
14	A	1127	1053	0.01
15	A	1116	1043	0.10
16	A	998	933	0.01
17	A	944	882	0.48
18	A	863	806	0.05
19	A	846	791	0.99
20	A	505	472	0.02
21	A	407	380	0.00
22	A	286	267	0.06
23	B	3232	3020	6.21
24	B	3186	2977	48.40
25	B	3156	2949	56.19
26	B	3121	2917	20.35
27	B	3102	2899	58.75
28	B	1546	1444	3.91
29	B	1539	1438	4.12
30	B	1459	1364	0.06
31	B	1419	1326	2.45
32	B	1386	1295	0.83
33	B	1330	1243	1.73
34	B	1191	1112	4.32
35	B	1087	1015	2.70
36	B	1045	976	0.76
37	B	962	899	3.52
38	B	923	862	3.22
39	B	747	698	9.85
40	B	663	620	18.72
41	B	459	429	0.78
42	B	172	161	0.19

Atom	x (Å)	y (Å)	z (Å)
C1	-0.007	-0.670	1.295
C2	0.007	0.670	1.295
C3	0.000	1.495	0.040
C4	0.000	-1.495	0.040
C5	-0.384	0.658	-1.176
C6	0.384	-0.658	-1.176
H7	-0.026	-1.198	2.241
H8	0.026	1.198	2.241
H9	0.988	1.940	-0.113
H10	-0.988	-1.940	-0.113
H11	-0.691	2.334	0.155
H12	0.691	-2.334	0.155
H13	-1.455	0.443	-1.141
H14	1.455	-0.443	-1.141
H15	-0.200	1.217	-2.094
H16	0.200	-1.217	-2.094

	C1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		1.3405	2.5032	1.5024	2.8312	2.5025	1.0837	2.0946	3.1286	2.1351	3.2845	2.1336	3.0445	2.8499	3.8845	3.4397
C2	1.3405		1.5024	2.5032	2.5025	2.8312	2.0946	1.0837	2.1351	3.1286	2.1336	3.2845	2.8499	3.0445	3.4397	3.8845
C3	2.5032	1.5024		2.9909	1.5258	2.5030	3.4790	2.2217	1.0946	3.5783	1.0920	3.8925	2.1487	2.6962	2.1616	3.4575
C4	1.5024	2.5032	2.9909		2.5030	1.5258	2.2217	3.4790	3.5783	1.0946	3.8925	1.0920	2.6962	2.1487	3.4575	2.1616
C5	2.8312	2.5025	1.5258	2.5030		1.5244	3.9058	3.4844	2.1586	2.8718	2.1621	3.4467	1.0925	2.1443	1.0905	2.1684
C6	2.5025	2.8312	2.5030	1.5258	1.5244		3.4844	3.9058	2.8718	2.1586	3.4467	2.1621	2.1443	1.0925	2.1684	1.0905
H7	1.0837	2.0946	3.4790	2.2217	3.9058	3.4844		2.3971	4.0524	2.6493	4.1552	2.4806	4.0215	3.7684	4.9663	4.3417
H8	2.0946	1.0837	2.2217	3.4790	3.4844	3.9058	2.3971		2.6493	4.0524	2.4806	4.1552	3.7684	4.0215	4.3417	4.9663
H9	3.1286	2.1351	1.0946	3.5783	2.1586	2.8718	4.0524	2.6493		4.3549	1.7452	4.2925	3.0441	2.6372	2.4212	3.8101
H10	2.1351	3.1286	3.5783	1.0946	2.8718	2.1586	2.6493	4.0524	4.3549		4.2925	1.7452	2.6372	3.0441	3.8101	2.4212
H11	3.2845	2.1336	1.0920	3.8925	2.1621	3.4467	4.1552	2.4806	1.7452	4.2925		4.8671	2.4159	3.7409	2.5589	4.2970
H12	2.1336	3.2845	3.8925	1.0920	3.4467	2.1621	2.4806	4.1552	4.2925	1.7452	4.8671		3.7409	2.4159	4.2970	2.5589
H13	3.0445	2.8499	2.1487	2.6962	1.0925	2.1443	4.0215	3.7684	3.0441	2.6372	2.4159	3.7409		3.0421	1.7557	2.5315
H14	2.8499	3.0445	2.6962	2.1487	2.1443	1.0925	3.7684	4.0215	2.6372	3.0441	3.7409	2.4159	3.0421		2.5315	1.7557
H15	3.8845	3.4397	2.1616	3.4575	1.0905	2.1684	4.9663	4.3417	2.4212	3.8101	2.5589	4.2970	1.7557	2.5315		2.4674
H16	3.4397	3.8845	3.4575	2.1616	2.1684	1.0905	4.3417	4.9663	3.8101	2.4212	4.2970	2.5589	2.5315	1.7557	2.4674

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.314	C1	C2	H8	119.174
C1	C4	C6	111.457	C1	C4	H10	109.601
C1	C4	H12	109.634	C2	C1	C4	123.314
C2	C1	H7	119.174	C2	C3	C5	111.457
C2	C3	H9	109.601	C2	C3	H11	109.634
C3	C2	H8	117.512	C3	C5	C6	110.291
C3	C5	H13	109.182	C3	C5	H15	110.312
C4	C1	H7	117.512	C4	C6	C5	110.291
C4	C6	H14	109.182	C4	C6	H16	110.312
C5	C3	H9	109.833	C5	C3	H11	110.260
C5	C6	H14	108.937	C5	C6	H16	110.957
C6	C4	H10	109.833	C6	C4	H12	110.260
C6	C5	H13	108.937	C6	C5	H15	110.957
H9	C3	H11	105.903	H10	C4	H12	105.903
H13	C5	H15	107.082	H14	C6	H16	107.082

All results from a given calculation for C₆H₁₀ (cyclohexene)

using model chemistry: MP2=FULL/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: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for C₆H₁₀ (cyclohexene)