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	hartrees
Energy at 0K	-692.001283
Energy at 298.15K
HF Energy	-691.059560
Nuclear repulsion energy	290.900622

Atom	x (Å)	y (Å)	z (Å)
C1	-1.352	-0.272	0.000
Cl2	-2.664	0.945	0.000
C3	0.000	0.412	0.000
C4	3.231	-1.305	0.000
C5	2.289	-0.120	0.000
O6	0.963	-0.613	0.000
H7	4.265	-0.965	0.000
H8	-1.466	-0.887	0.886
H9	-1.466	-0.887	-0.886
H10	0.093	1.053	-0.885
H11	0.093	1.053	0.885
H12	3.064	-1.918	-0.883
H13	3.064	-1.918	0.883
H14	2.461	0.508	0.883
H15	2.461	0.508	-0.883

	C1	Cl2	C3	C4	C5	O6	H7	H8	H9	H10	H11	H12	H13	H14	H15
C1		1.7891	1.5157	4.6985	3.6443	2.3406	5.6604	1.0847	1.0847	2.1507	2.1507	4.7951	4.7951	3.9915	3.9915
Cl2	1.7891		2.7164	6.3098	5.0656	3.9475	7.1876	2.3617	2.3617	2.8969	2.8969	6.4640	6.4640	5.2190	5.2190
C3	1.5157	2.7164		3.6594	2.3499	1.4070	4.4824	2.1502	2.1502	1.0959	1.0959	3.9495	3.9495	2.6168	2.6168
C4	4.6985	6.3098	3.6594		1.5145	2.3712	1.0887	4.7981	4.7981	4.0239	4.0239	1.0877	1.0877	2.1584	2.1584
C5	3.6443	5.0656	2.3499	1.5145		1.4144	2.1499	3.9334	3.9334	2.6419	2.6419	2.1482	2.1482	1.0968	1.0968
O6	2.3406	3.9475	1.4070	2.3712	1.4144		3.3209	2.6002	2.6002	2.0772	2.0772	2.6259	2.6259	2.0688	2.0688
H7	5.6604	7.1876	4.4824	1.0887	2.1499	3.3209		5.7999	5.7999	4.7187	4.7187	1.7694	1.7694	2.4907	2.4907
H8	1.0847	2.3617	2.1502	4.7981	3.9334	2.6002	5.7999		1.7718	3.0542	2.4886	4.9709	4.6456	4.1677	4.5276
H9	1.0847	2.3617	2.1502	4.7981	3.9334	2.6002	5.7999	1.7718		2.4886	3.0542	4.6456	4.9709	4.5276	4.1677
H10	2.1507	2.8969	1.0959	4.0239	2.6419	2.0772	4.7187	3.0542	2.4886		1.7694	4.2015	4.5582	3.0054	2.4306
H11	2.1507	2.8969	1.0959	4.0239	2.6419	2.0772	4.7187	2.4886	3.0542	1.7694		4.5582	4.2015	2.4306	3.0054
H12	4.7951	6.4640	3.9495	1.0877	2.1482	2.6259	1.7694	4.9709	4.6456	4.2015	4.5582		1.7660	3.0603	2.4993
H13	4.7951	6.4640	3.9495	1.0877	2.1482	2.6259	1.7694	4.6456	4.9709	4.5582	4.2015	1.7660		2.4993	3.0603
H14	3.9915	5.2190	2.6168	2.1584	1.0968	2.0688	2.4907	4.1677	4.5276	3.0054	2.4306	3.0603	2.4993		1.7661
H15	3.9915	5.2190	2.6168	2.1584	1.0968	2.0688	2.4907	4.5276	4.1677	2.4306	3.0054	2.4993	3.0603	1.7661

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	O6	106.362	C1	C3	H10	109.833
C1	C3	H11	109.833	Cl2	C1	C3	110.291
Cl2	C1	H8	108.017	Cl2	C1	H9	108.017
C3	C1	H8	110.464	C3	C1	H9	110.464
C3	O6	C5	112.789	C4	C5	O6	108.061
C4	C5	H14	110.472	C4	C5	H15	110.472
C5	C4	H7	110.283	C5	C4	H12	110.204
C5	C4	H13	110.204	O6	C3	H10	111.578
O6	C3	H11	111.578	O6	C5	H14	110.306
O6	C5	H15	110.306	H7	C4	H12	108.781
H7	C4	H13	108.781	H8	C1	H9	109.519
H10	C3	H11	107.661	H12	C4	H13	108.544
H14	C5	H15	107.238

All results from a given calculation for C₄H₉ClO (1-Chloro-2-ethoxyethane)

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 C4H9ClO (1-Chloro-2-ethoxyethane)

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

States and conformations

All results from a given calculation for C₄H₉ClO (1-Chloro-2-ethoxyethane)