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	hartrees
Energy at 0K	-233.437462
Energy at 298.15K
HF Energy	-232.916167
Nuclear repulsion energy	239.172430

Atom	x (Å)	y (Å)	z (Å)
C1	-0.171	1.482	0.000
C2	-0.946	-1.333	0.000
C3	0.292	0.645	1.257
C4	0.292	0.645	-1.257
C5	0.292	-0.828	0.772
C6	0.292	-0.828	-0.772
H7	-1.129	-2.412	0.000
H8	-1.866	-0.740	0.000
H9	-1.270	1.595	0.000
H10	0.257	2.500	0.000
H11	-0.361	0.810	2.134
H12	-0.361	0.810	-2.134
H13	1.323	0.926	-1.549
H14	1.323	0.926	1.549
H15	0.886	-1.557	1.333
H16	0.886	-1.557	-1.333

	C1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		2.9200	1.5794	1.5794	2.4788	2.4788	4.0101	2.7947	1.1053	1.1046	2.2454	2.2454	2.2227	2.2227	3.4820	3.4820
C2	2.9200		2.6504	2.6504	1.5444	1.5444	1.0942	1.0946	2.9460	4.0180	3.0808	3.0808	3.5570	3.5570	2.2763	2.2763
C3	1.5794	2.6504		2.5135	1.5499	2.5068	3.5974	2.8554	2.2188	2.2415	1.1062	3.4571	3.0026	1.1078	2.2812	3.4500
C4	1.5794	2.6504	2.5135		2.5068	1.5499	3.5974	2.8554	2.2188	2.2415	3.4571	1.1062	1.1078	3.0026	3.4500	2.2812
C5	2.4788	1.5444	1.5499	2.5068		1.5444	2.2640	2.2938	2.9842	3.4166	2.2280	3.3993	3.0865	2.1774	1.0945	2.3052
C6	2.4788	1.5444	2.5068	1.5499	1.5444		2.2640	2.2938	2.9842	3.4166	3.3993	2.2280	2.1774	3.0865	2.3052	1.0945
H7	4.0101	1.0942	3.5974	3.5974	2.2640	2.2640		1.8276	4.0095	5.1042	3.9404	3.9404	4.4218	4.4218	2.5623	2.5623
H8	2.7947	1.0946	2.8554	2.8554	2.2938	2.2938	1.8276		2.4095	3.8737	3.0367	3.0367	3.9171	3.9171	3.1646	3.1646
H9	1.1053	2.9460	2.2188	2.2188	2.9842	2.9842	4.0095	2.4095		1.7753	2.4488	2.4488	3.0939	3.0939	4.0442	4.0442
H10	1.1046	4.0180	2.2415	2.2415	3.4166	3.4166	5.1042	3.8737	1.7753		2.7915	2.7915	2.4528	2.4528	4.3163	4.3163
H11	2.2454	3.0808	1.1062	3.4571	2.2280	3.3993	3.9404	3.0367	2.4488	2.7915		4.2682	4.0517	1.7863	2.7927	4.3788
H12	2.2454	3.0808	3.4571	1.1062	3.3993	2.2280	3.9404	3.0367	2.4488	2.7915	4.2682		1.7863	4.0517	4.3788	2.7927
H13	2.2227	3.5570	3.0026	1.1078	3.0865	2.1774	4.4218	3.9171	3.0939	2.4528	4.0517	1.7863		3.0986	3.8287	2.5300
H14	2.2227	3.5570	1.1078	3.0026	2.1774	3.0865	4.4218	3.9171	3.0939	2.4528	1.7863	4.0517	3.0986		2.5300	3.8287
H15	3.4820	2.2763	2.2812	3.4500	1.0945	2.3052	2.5623	3.1646	4.0442	4.3163	2.7927	4.3788	3.8287	2.5300		2.6651
H16	3.4820	2.2763	3.4500	2.2812	2.3052	1.0945	2.5623	3.1646	4.0442	4.3163	4.3788	2.7927	2.5300	3.8287	2.6651

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C5	104.763	C1	C3	H11	112.258
C1	C3	H14	110.376	C1	C4	C6	104.763
C1	C4	H12	112.258	C1	C4	H13	110.376
C2	C5	C3	117.856	C2	C5	C6	60.001
C2	C5	H15	118.213	C2	C6	C4	117.856
C2	C6	C5	60.001	C2	C6	H16	118.213
C3	C1	C4	105.444	C3	C1	H9	110.218
C3	C1	H10	112.051	C3	C5	C6	108.217
C3	C5	H15	118.210	C4	C1	H9	110.218
C4	C1	H10	112.051	C4	C6	C5	108.217
C4	C6	H16	118.210	C5	C2	C6	59.998
C5	C2	H7	117.165	C5	C2	H8	119.751
C5	C3	H11	112.964	C5	C3	H14	108.884
C5	C6	H16	120.797	C6	C2	H7	117.165
C6	C2	H8	119.751	C6	C4	H12	112.964
C6	C4	H13	108.884	C6	C5	H15	120.797
H7	C2	H8	113.226	H9	C1	H10	106.904
H11	C3	H14	107.570	H12	C4	H13	107.570

All results from a given calculation for C₆H₁₀ (Bicyclo[3.1.0]hexane)

using model chemistry: MP2/SDD

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 (Bicyclo[3.1.0]hexane)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for C₆H₁₀ (Bicyclo[3.1.0]hexane)