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	hartrees
Energy at 0K	-231.748478
Energy at 298.15K
HF Energy	-230.965307
Nuclear repulsion energy	174.253474

Atom	x (Å)	y (Å)	z (Å)
C1	-2.433	-0.291	0.075
H2	-2.468	-1.355	0.245
H3	-3.361	0.254	0.027
C4	-1.275	0.349	-0.095
H5	-1.228	1.421	-0.268
O6	-0.079	-0.302	-0.112
C7	1.053	0.521	0.131
H8	1.005	0.946	1.138
H9	1.073	1.354	-0.580
C10	2.290	-0.337	-0.024
H11	2.269	-1.160	0.688
H12	2.337	-0.751	-1.029
H13	3.185	0.257	0.154

	C1	H2	H3	C4	H5	O6	C7	H8	H9	C10	H11	H12	H13
C1		1.0788	1.0772	1.3334	2.1209	2.3614	3.5794	3.8044	3.9271	4.7244	4.8204	4.9174	5.6448
H2	1.0788		1.8532	2.1078	3.0835	2.6352	3.9913	4.2606	4.5339	4.8734	4.7616	5.0075	5.8790
H3	1.0772	1.8532		2.0917	2.4494	3.3320	4.4234	4.5575	4.6086	5.6825	5.8422	5.8815	6.5472
C4	1.3334	2.1078	2.0917		1.0868	1.3622	2.3454	2.6598	2.5996	3.6316	3.9305	3.8895	4.4679
H5	2.1209	3.0835	2.4494	1.0868		2.0770	2.4843	2.6805	2.3230	3.9407	4.4497	4.2431	4.5831
O6	2.3614	2.6352	3.3320	1.3622	2.0770		1.4204	2.0724	2.0705	2.3710	2.6242	2.6225	3.3219
C7	3.5794	3.9913	4.4234	2.3454	2.4843	1.4204		1.0943	1.0953	1.5139	2.1476	2.1474	2.1482
H8	3.8044	4.2606	4.5575	2.6598	2.6805	2.0724	1.0943		1.7674	2.1569	2.4973	3.0581	2.4897
H9	3.9271	4.5339	4.6086	2.5996	2.3230	2.0705	1.0953	1.7674		2.1566	3.0584	2.4954	2.4902
C10	4.7244	4.8734	5.6825	3.6316	3.9407	2.3710	1.5139	2.1569	2.1566		1.0876	1.0876	1.0887
H11	4.8204	4.7616	5.8422	3.9305	4.4497	2.6242	2.1476	2.4973	3.0584	1.0876		1.7660	1.7695
H12	4.9174	5.0075	5.8815	3.8895	4.2431	2.6225	2.1474	3.0581	2.4954	1.0876	1.7660		1.7701
H13	5.6448	5.8790	6.5472	4.4679	4.5831	3.3219	2.1482	2.4897	2.4902	1.0887	1.7695	1.7701

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	122.074	C1	C4	O6	122.331
H2	C1	H3	118.532	H2	C1	C4	121.450
H3	C1	C4	120.009	C4	O6	C7	114.877
H5	C4	O6	115.557	O6	C7	H8	110.324
O6	C7	H9	110.111	O6	C7	C10	107.765
C7	C10	H11	110.213	C7	C10	H12	110.191
C7	C10	H13	110.193	H8	C7	H9	107.646
H8	C7	C10	110.545	H9	C7	C10	110.463
H11	C10	H12	108.557	H11	C10	H13	108.797
H12	C10	H13	108.848

All results from a given calculation for C₂H₃OC₂H₅ (Ethene, ethoxy-)

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 C2H3OC2H5 (Ethene, ethoxy-)

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

States and conformations

All results from a given calculation for C₂H₃OC₂H₅ (Ethene, ethoxy-)