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	hartrees
Energy at 0K	-233.896051
Energy at 298.15K
HF Energy	-233.008453
Nuclear repulsion energy	213.311024

Atom	x (Å)	y (Å)	z (Å)
H1	-0.929	2.595	0.000
C2	-1.088	1.523	0.000
H3	0.968	1.218	0.000
C4	0.000	0.733	0.000
H5	-0.968	-1.218	0.000
C6	0.000	-0.733	0.000
H7	0.929	-2.595	0.000
C8	1.088	-1.523	0.000
H9	2.652	-0.022	0.000
H10	3.041	-1.499	0.877
H11	3.041	-1.499	-0.877
C12	2.530	-1.101	0.000
H13	-2.652	0.022	0.000
H14	-3.041	1.499	0.877
H15	-3.041	1.499	-0.877
C16	-2.530	1.101	0.000

	H1	C2	H3	C4	H5	C6	H7	C8	H9	H10	H11	C12	H13	H14	H15	C16
H1		1.0844	2.3443	2.0814	3.8136	3.4554	5.5132	4.5853	4.4355	5.7704	5.7704	5.0625	3.0971	2.5365	2.5365	2.1893
C2	1.0844		2.0780	1.3441	2.7434	2.5040	4.5853	3.7424	4.0460	5.1912	5.1912	4.4688	2.1680	2.1419	2.1419	1.5022
H3	2.3443	2.0780		1.0828	3.1118	2.1779	3.8136	2.7433	2.0912	3.5286	3.5286	2.7963	3.8126	4.1139	4.1139	3.4996
C4	2.0814	1.3441	1.0828		2.1779	1.4657	3.4554	2.5040	2.7573	3.8731	3.8731	3.1247	2.7458	3.2569	3.2569	2.5564
H5	3.8136	2.7434	3.1118	2.1779		1.0828	2.3443	2.0780	3.8126	4.1139	4.1139	3.4995	2.0913	3.5286	3.5286	2.7963
C6	3.4554	2.5040	2.1779	1.4657	1.0828		2.0814	1.3441	2.7457	3.2569	3.2569	2.5564	2.7573	3.8731	3.8731	3.1247
H7	5.5132	4.5853	3.8136	3.4554	2.3443	2.0814		1.0844	3.0971	2.5365	2.5365	2.1893	4.4355	5.7704	5.7704	5.0625
C8	4.5853	3.7424	2.7433	2.5040	2.0780	1.3441	1.0844		2.1680	2.1419	2.1419	1.5022	4.0460	5.1912	5.1912	4.4688
H9	4.4355	4.0460	2.0912	2.7573	3.8126	2.7457	3.0971	2.1680		1.7617	1.7617	1.0867	5.3043	5.9580	5.9580	5.3020
H10	5.7704	5.1912	3.5286	3.8731	4.1139	3.2569	2.5365	2.1419	1.7617		1.7547	1.0907	5.9580	6.7815	7.0048	6.2104
H11	5.7704	5.1912	3.5286	3.8731	4.1139	3.2569	2.5365	2.1419	1.7617	1.7547		1.0907	5.9580	7.0048	6.7815	6.2104
C12	5.0625	4.4688	2.7963	3.1247	3.4995	2.5564	2.1893	1.5022	1.0867	1.0907	1.0907		5.3020	6.2104	6.2104	5.5181
H13	3.0971	2.1680	3.8126	2.7458	2.0913	2.7573	4.4355	4.0460	5.3043	5.9580	5.9580	5.3020		1.7617	1.7617	1.0867
H14	2.5365	2.1419	4.1139	3.2569	3.5286	3.8731	5.7704	5.1912	5.9580	6.7815	7.0048	6.2104	1.7617		1.7547	1.0907
H15	2.5365	2.1419	4.1139	3.2569	3.5286	3.8731	5.7704	5.1912	5.9580	7.0048	6.7815	6.2104	1.7617	1.7547		1.0907
C16	2.1893	1.5022	3.4996	2.5564	2.7963	3.1247	5.0625	4.4688	5.3020	6.2104	6.2104	5.5181	1.0867	1.0907	1.0907

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	117.578	H1	C2	C16	114.686
C2	C4	H3	117.389	C2	C4	C6	125.982
C2	C16	H13	112.748	C2	C16	H14	110.383
C2	C16	H15	110.383	H3	C4	C6	116.628
C4	C2	C16	127.736	C4	C6	H5	116.628
C4	C6	C8	125.982	H5	C6	C8	117.389
C6	C8	H7	117.578	C6	C8	C12	127.736
H7	C8	C12	114.687	C8	C12	H9	112.748
C8	C12	H10	110.383	C8	C12	H11	110.383
H9	C12	H10	108.011	H9	C12	H11	108.011
H10	C12	H11	107.103	H13	C16	H14	108.010
H13	C16	H15	108.010	H14	C16	H15	107.103

All results from a given calculation for C₆H₁₀ (2,4-Hexadiene, (Z,Z)-)

using model chemistry: MP3/6-31+G**

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 (2,4-Hexadiene, (Z,Z)-)

using model chemistry: MP3/6-31+G**

States and conformations

All results from a given calculation for C₆H₁₀ (2,4-Hexadiene, (Z,Z)-)