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	hartrees
Energy at 0K	-39.529792
Energy at 298.15K	-39.541322
HF Energy	-38.748276
Nuclear repulsion energy	128.410211

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3188	3038	47.46
2	A	3118	2971	44.11
3	A	3099	2952	1.39
4	A	3059	2914	29.91
5	A	3044	2900	0.15
6	A	1685	1605	2.77
7	A	1541	1468	2.17
8	A	1513	1441	0.23
9	A	1403	1337	0.00
10	A	1400	1334	0.25
11	A	1282	1222	0.89
12	A	1255	1196	0.07
13	A	1164	1109	0.09
14	A	1104	1052	0.03
15	A	1093	1041	0.04
16	A	945	901	0.01
17	A	922	879	1.38
18	A	844	804	0.03
19	A	820	781	1.11
20	A	492	469	0.07
21	A	398	379	0.02
22	A	274	261	0.04
23	B	3165	3016	9.35
24	B	3125	2978	65.86
25	B	3098	2952	65.49
26	B	3058	2914	28.54
27	B	3044	2900	75.13
28	B	1529	1457	6.45
29	B	1521	1449	7.71
30	B	1425	1358	0.15
31	B	1398	1332	1.96
32	B	1358	1294	0.99
33	B	1304	1242	2.57
34	B	1169	1114	6.76
35	B	1065	1015	2.91
36	B	1024	975	1.07
37	B	936	891	6.28
38	B	903	860	4.98
39	B	732	697	15.27
40	B	645	615	29.20
41	B	447	426	1.19
42	B	159	152	0.14

Atom	x (Å)	y (Å)	z (Å)
C1	-0.009	-0.677	1.306
C2	0.009	0.677	1.306
C3	0.000	1.510	0.038
C4	0.000	-1.510	0.038
C5	-0.392	0.662	-1.185
C6	0.392	-0.662	-1.185
H7	-0.030	-1.205	2.260
H8	0.030	1.205	2.260
H9	0.996	1.954	-0.118
H10	-0.996	-1.954	-0.118
H11	-0.696	2.352	0.157
H12	0.696	-2.352	0.157
H13	-1.468	0.442	-1.140
H14	1.468	-0.442	-1.140
H15	-0.210	1.224	-2.110
H16	0.210	-1.224	-2.110

	C1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		1.3535	2.5278	1.5174	2.8536	2.5230	1.0912	2.1102	3.1552	2.1525	3.3111	2.1500	3.0597	2.8665	3.9145	3.4666
C2	1.3535		1.5174	2.5278	2.5230	2.8536	2.1102	1.0912	2.1525	3.1552	2.1500	3.3111	2.8665	3.0597	3.4666	3.9145
C3	2.5278	1.5174		3.0199	1.5390	2.5229	3.5087	2.2437	1.1012	3.6073	1.0987	3.9256	2.1640	2.7111	2.1772	3.4832
C4	1.5174	2.5278	3.0199		2.5229	1.5390	2.2437	3.5087	3.6073	1.1012	3.9256	1.0987	2.7111	2.1640	3.4832	2.1772
C5	2.8536	2.5230	1.5390	2.5229		1.5376	3.9353	3.5135	2.1753	2.8885	2.1792	3.4732	1.0994	2.1624	1.0977	2.1848
C6	2.5230	2.8536	2.5229	1.5390	1.5376		3.5135	3.9353	2.8885	2.1753	3.4732	2.1792	2.1624	1.0994	2.1848	1.0977
H7	1.0912	2.1102	3.5087	2.2437	3.9353	3.5135		2.4104	4.0849	2.6743	4.1854	2.5036	4.0424	3.7932	5.0035	4.3774
H8	2.1102	1.0912	2.2437	3.5087	3.5135	3.9353	2.4104		2.6743	4.0849	2.5036	4.1854	3.7932	4.0424	4.3774	5.0035
H9	3.1552	2.1525	1.1012	3.6073	2.1753	2.8885	4.0849	2.6743		4.3856	1.7598	4.3243	3.0658	2.6465	2.4403	3.8317
H10	2.1525	3.1552	3.6073	1.1012	2.8885	2.1753	2.6743	4.0849	4.3856		4.3243	1.7598	2.6465	3.0658	3.8317	2.4403
H11	3.3111	2.1500	1.0987	3.9256	2.1792	3.4732	4.1854	2.5036	1.7598	4.3243		4.9049	2.4339	3.7638	2.5782	4.3295
H12	2.1500	3.3111	3.9256	1.0987	3.4732	2.1792	2.5036	4.1854	4.3243	1.7598	4.9049		3.7638	2.4339	4.3295	2.5782
H13	3.0597	2.8665	2.1640	2.7111	1.0994	2.1624	4.0424	3.7932	3.0658	2.6465	2.4339	3.7638		3.0654	1.7705	2.5556
H14	2.8665	3.0597	2.7111	2.1640	2.1624	1.0994	3.7932	4.0424	2.6465	3.0658	3.7638	2.4339	3.0654		2.5556	1.7705
H15	3.9145	3.4666	2.1772	3.4832	1.0977	2.1848	5.0035	4.3774	2.4403	3.8317	2.5782	4.3295	1.7705	2.5556		2.4836
H16	3.4666	3.9145	3.4832	2.1772	2.1848	1.0977	4.3774	5.0035	3.8317	2.4403	4.3295	2.5782	2.5556	1.7705	2.4836

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.301	C1	C2	H8	118.962
C1	C4	C6	111.273	C1	C4	H10	109.547
C1	C4	H12	109.498	C2	C1	C4	123.301
C2	C1	H7	118.962	C2	C3	C5	111.273
C2	C3	H9	109.547	C2	C3	H11	109.498
C3	C2	H8	117.736	C3	C5	C6	110.171
C3	C5	H13	109.069	C3	C5	H15	110.206
C4	C1	H7	117.736	C4	C6	C5	110.171
C4	C6	H14	109.069	C4	C6	H16	110.206
C5	C3	H9	109.848	C5	C3	H11	110.301
C5	C6	H14	109.042	C5	C6	H16	110.897
C6	C4	H10	109.848	C6	C4	H12	110.301
C6	C5	H13	109.042	C6	C5	H15	110.897
H9	C3	H11	106.246	H10	C4	H12	106.246
H13	C5	H15	107.388	H14	C6	H16	107.388

All results from a given calculation for C₆H₁₀ (cyclohexene)

using model chemistry: MP2/CEP-121G*

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/CEP-121G*

States and conformations

All results from a given calculation for C₆H₁₀ (cyclohexene)