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	hartrees
Energy at 0K	-233.937475
Energy at 298.15K
HF Energy	-233.034597
Nuclear repulsion energy	236.833887

Atom	x (Å)	y (Å)	z (Å)
C1	-0.005	-0.670	1.303
C2	0.005	0.670	1.303
C3	0.000	1.501	0.042
C4	0.000	-1.501	0.042
C5	-0.380	0.664	-1.184
C6	0.380	-0.664	-1.184
H7	-0.022	-1.203	2.248
H8	0.022	1.203	2.248
H9	0.991	1.948	-0.105
H10	-0.991	-1.948	-0.105
H11	-0.694	2.339	0.156
H12	0.694	-2.339	0.156
H13	-1.455	0.458	-1.160
H14	1.455	-0.458	-1.160
H15	-0.182	1.225	-2.101
H16	0.182	-1.225	-2.101

	C1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		1.3408	2.5112	1.5102	2.8468	2.5162	1.0852	2.0985	3.1352	2.1417	3.2936	2.1421	3.0729	2.8709	3.8993	3.4532
C2	1.3408		1.5102	2.5112	2.5162	2.8468	2.0985	1.0852	2.1417	3.1352	2.1421	3.2936	2.8709	3.0729	3.4532	3.8993
C3	2.5112	1.5102		3.0023	1.5320	2.5167	3.4902	2.2267	1.0966	3.5915	1.0940	3.9043	2.1562	2.7205	2.1675	3.4715
C4	1.5102	2.5112	3.0023		2.5167	1.5320	2.2267	3.4902	3.5915	1.0966	3.9043	1.0940	2.7205	2.1562	3.4715	2.1675
C5	2.8468	2.5162	1.5320	2.5167		1.5303	3.9232	3.4971	2.1658	2.8909	2.1679	3.4595	1.0948	2.1516	1.0926	2.1734
C6	2.5162	2.8468	2.5167	1.5320	1.5303		3.4971	3.9232	2.8909	2.1658	3.4595	2.1679	2.1516	1.0948	2.1734	1.0926
H7	1.0852	2.0985	3.4902	2.2267	3.9232	3.4971		2.4064	4.0611	2.6517	4.1684	2.4861	4.0532	3.7884	4.9829	4.3534
H8	2.0985	1.0852	2.2267	3.4902	3.4971	3.9232	2.4064		2.6517	4.0611	2.4861	4.1684	3.7884	4.0532	4.3534	4.9829
H9	3.1352	2.1417	1.0966	3.5915	2.1658	2.8909	4.0611	2.6517		4.3707	1.7489	4.3054	3.0518	2.6680	2.4248	3.8339
H10	2.1417	3.1352	3.5915	1.0966	2.8909	2.1658	2.6517	4.0611	4.3707		4.3054	1.7489	2.6680	3.0518	3.8339	2.4248
H11	3.2936	2.1421	1.0940	3.9043	2.1679	3.4595	4.1684	2.4861	1.7489	4.3054		4.8800	2.4186	3.7652	2.5682	4.3082
H12	2.1421	3.2936	3.9043	1.0940	3.4595	2.1679	2.4861	4.1684	4.3054	1.7489	4.8800		3.7652	2.4186	4.3082	2.5682
H13	3.0729	2.8709	2.1562	2.7205	1.0948	2.1516	4.0532	3.7884	3.0518	2.6680	2.4186	3.7652		3.0516	1.7584	2.5297
H14	2.8709	3.0729	2.7205	2.1562	2.1516	1.0948	3.7884	4.0532	2.6680	3.0518	3.7652	2.4186	3.0516		2.5297	1.7584
H15	3.8993	3.4532	2.1675	3.4715	1.0926	2.1734	4.9829	4.3534	2.4248	3.8339	2.5682	4.3082	1.7584	2.5297		2.4763
H16	3.4532	3.8993	3.4715	2.1675	2.1734	1.0926	4.3534	4.9829	3.8339	2.4248	4.3082	2.5682	2.5297	1.7584	2.4763

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.371	C1	C2	H8	119.401
C1	C4	C6	111.601	C1	C4	H10	109.460
C1	C4	H12	109.644	C2	C1	C4	123.371
C2	C1	H7	119.401	C2	C3	C5	111.601
C2	C3	H9	109.460	C2	C3	H11	109.644
C3	C2	H8	117.228	C3	C5	C6	110.539
C3	C5	H13	109.208	C3	C5	H15	110.228
C4	C1	H7	117.228	C4	C6	C5	110.539
C4	C6	H14	109.208	C4	C6	H16	110.228
C5	C3	H9	109.858	C5	C3	H11	110.175
C5	C6	H14	108.967	C5	C6	H16	110.811
C6	C4	H10	109.858	C6	C4	H12	110.175
C6	C5	H13	108.967	C6	C5	H15	110.811
H9	C3	H11	105.943	H10	C4	H12	105.943
H13	C5	H15	107.000	H14	C6	H16	107.000

All results from a given calculation for C₆H₁₀ (cyclohexene)

using model chemistry: QCISD/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: QCISD/6-31G**

States and conformations

All results from a given calculation for C₆H₁₀ (cyclohexene)