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	hartrees
Energy at 0K	-270.942843
Energy at 298.15K
HF Energy	-269.997207
Nuclear repulsion energy	257.531915

Atom	x (Å)	y (Å)	z (Å)
C1	-1.264	1.290	0.000
H2	-1.276	1.932	0.882
H3	-1.276	1.932	-0.882
H4	-2.177	0.695	0.000
C5	1.253	1.218	0.000
H6	2.127	0.566	0.000
H7	1.303	1.856	-0.883
H8	1.303	1.856	0.883
C9	-0.031	0.399	0.000
C10	-0.031	-0.755	1.032
C11	-0.031	-0.755	-1.032
H12	0.800	-0.761	1.741
H13	0.800	-0.761	-1.741
H14	-0.968	-0.868	1.584
H15	-0.968	-0.868	-1.584
O16	0.119	-1.745	0.000

	C1	H2	H3	H4	C5	H6	H7	H8	C9	C10	C11	H12	H13	H14	H15	O16
C1		1.0906	1.0906	1.0896	2.5183	3.4670	2.7732	2.7732	1.5214	2.6018	2.6018	3.3906	3.3906	2.6938	2.6938	3.3355
H2	1.0906		1.7635	1.7659	2.7719	3.7708	3.1259	2.5802	2.1627	2.9655	3.5260	3.5066	4.2939	2.9033	3.7439	4.0302
H3	1.0906	1.7635		1.7659	2.7719	3.7708	2.5802	3.1259	2.1627	3.5260	2.9655	4.2939	3.5066	3.7439	2.9033	4.0302
H4	1.0896	1.7659	1.7659		3.4698	4.3054	3.7735	3.7735	2.1662	2.7882	2.7882	3.7432	3.7432	2.5329	2.5329	3.3508
C5	2.5183	2.7719	2.7719	3.4698		1.0898	1.0905	1.0905	1.5234	2.5707	2.5707	2.6744	2.6744	3.4348	3.4348	3.1723
H6	3.4670	3.7708	3.7708	4.3054	1.0898		1.7668	1.7668	2.1642	2.7325	2.7325	2.5599	2.5599	3.7611	3.7611	3.0609
H7	2.7732	3.1259	2.5802	3.7735	1.0905	1.7668		1.7656	2.1644	3.5025	2.9367	3.7400	2.7998	4.3209	3.6161	3.8922
H8	2.7732	2.5802	3.1259	3.7735	1.0905	1.7668	1.7656		2.1644	2.9367	3.5025	2.7998	3.7400	3.6161	4.3209	3.8922
C9	1.5214	2.1627	2.1627	2.1662	1.5234	2.1642	2.1644	2.1644		1.5481	1.5481	2.2508	2.2508	2.2347	2.2347	2.1489
C10	2.6018	2.9655	3.5260	2.7882	2.5707	2.7325	3.5025	2.9367	1.5481		2.0633	1.0925	2.8946	1.0939	2.7810	1.4373
C11	2.6018	3.5260	2.9655	2.7882	2.5707	2.7325	2.9367	3.5025	1.5481	2.0633		2.8946	1.0925	2.7810	1.0939	1.4373
H12	3.3906	3.5066	4.2939	3.7432	2.6744	2.5599	3.7400	2.7998	2.2508	1.0925	2.8946		3.4824	1.7782	3.7677	2.1126
H13	3.3906	4.2939	3.5066	3.7432	2.6744	2.5599	2.7998	3.7400	2.2508	2.8946	1.0925	3.4824		3.7677	1.7782	2.1126
H14	2.6938	2.9033	3.7439	2.5329	3.4348	3.7611	4.3209	3.6161	2.2347	1.0939	2.7810	1.7782	3.7677		3.1685	2.1122
H15	2.6938	3.7439	2.9033	2.5329	3.4348	3.7611	3.6161	4.3209	2.2347	2.7810	1.0939	3.7677	1.7782	3.1685		2.1122
O16	3.3355	4.0302	4.0302	3.3508	3.1723	3.0609	3.8922	3.8922	2.1489	1.4373	1.4373	2.1126	2.1126	2.1122	2.1122

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C9	C5	111.599	C1	C9	C10	115.906
C1	C9	C11	115.906	H2	C1	H3	107.901
H2	C1	H4	108.189	H2	C1	C9	110.704
H3	C1	H4	108.189	H3	C1	C9	110.704
H4	C1	C9	111.041	C5	C9	C10	113.636
C5	C9	C11	113.636	H6	C5	H7	108.261
H6	C5	H8	108.261	H6	C5	C9	110.731
H7	C5	H8	108.091	H7	C5	C9	110.700
H8	C5	C9	110.700	C9	C10	H12	115.871
C9	C10	H14	114.427	C9	C10	O16	91.999
C9	C11	H13	115.871	C9	C11	H15	114.427
C9	C11	O16	91.999	C10	C9	C11	83.580
C10	O16	C11	91.744	H12	C10	H14	108.842
H12	C10	O16	112.537	H13	C11	H15	108.842
H13	C11	O16	112.537	H14	C10	O16	112.417
H15	C11	O16	112.417

All results from a given calculation for C₅H₁₀O (Oxetane, 3,3-dimethyl-)

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 C5H10O (Oxetane, 3,3-dimethyl-)

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

States and conformations

All results from a given calculation for C₅H₁₀O (Oxetane, 3,3-dimethyl-)