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	hartrees
Energy at 0K	-232.939007
Energy at 298.15K	-232.950237
HF Energy	-232.163891
Nuclear repulsion energy	189.853255

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.274
C2	0.000	1.182	-0.522
C3	0.000	-1.182	-0.522
C4	0.000	2.374	0.409
C5	0.000	-2.374	0.409
H6	0.887	1.190	-1.169
H7	-0.887	1.190	-1.169
H8	0.887	-1.190	-1.169
H9	-0.887	-1.190	-1.169
H10	0.000	3.301	-0.166
H11	0.000	-3.301	-0.166
H12	-0.884	2.356	1.043
H13	0.884	2.356	1.043
H14	0.884	-2.356	1.043
H15	-0.884	-2.356	1.043

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13	H14	H15
O1		1.4252	1.4252	2.3780	2.3780	2.0699	2.0699	2.0699	2.0699	3.3304	3.3304	2.6317	2.6317	2.6317	2.6317
C2	1.4252		2.3641	1.5123	3.6759	1.0974	1.0974	2.6138	2.6138	2.1488	4.4973	2.1472	2.1472	3.9689	3.9689
C3	1.4252	2.3641		3.6759	1.5123	2.6138	2.6138	1.0974	1.0974	4.4973	2.1488	3.9689	3.9689	2.1472	2.1472
C4	2.3780	1.5123	3.6759		4.7485	2.1622	2.1622	3.9973	3.9973	1.0905	5.7044	1.0886	1.0886	4.8543	4.8543
C5	2.3780	3.6759	1.5123	4.7485		3.9973	3.9973	2.1622	2.1622	5.7044	1.0905	4.8543	4.8543	1.0886	1.0886
H6	2.0699	1.0974	2.6138	2.1622	3.9973		1.7733	2.3805	2.9684	2.4994	4.6865	3.0639	2.5002	4.1797	4.5395
H7	2.0699	1.0974	2.6138	2.1622	3.9973	1.7733		2.9684	2.3805	2.4994	4.6865	2.5002	3.0639	4.5395	4.1797
H8	2.0699	2.6138	1.0974	3.9973	2.1622	2.3805	2.9684		1.7733	4.6865	2.4994	4.5395	4.1797	2.5002	3.0639
H9	2.0699	2.6138	1.0974	3.9973	2.1622	2.9684	2.3805	1.7733		4.6865	2.4994	4.1797	4.5395	3.0639	2.5002
H10	3.3304	2.1488	4.4973	1.0905	5.7044	2.4994	2.4994	4.6865	4.6865		6.6022	1.7709	1.7709	5.8525	5.8525
H11	3.3304	4.4973	2.1488	5.7044	1.0905	4.6865	4.6865	2.4994	2.4994	6.6022		5.8525	5.8525	1.7709	1.7709
H12	2.6317	2.1472	3.9689	1.0886	4.8543	3.0639	2.5002	4.5395	4.1797	1.7709	5.8525		1.7688	5.0339	4.7129
H13	2.6317	2.1472	3.9689	1.0886	4.8543	2.5002	3.0639	4.1797	4.5395	1.7709	5.8525	1.7688		4.7129	5.0339
H14	2.6317	3.9689	2.1472	4.8543	1.0886	4.1797	4.5395	2.5002	3.0639	5.8525	1.7709	5.0339	4.7129		1.7688
H15	2.6317	3.9689	2.1472	4.8543	1.0886	4.5395	4.1797	3.0639	2.5002	5.8525	1.7709	4.7129	5.0339	1.7688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C4	108.067	O1	C2	H6	109.596
O1	C2	H7	109.596	O1	C3	C5	108.067
O1	C3	H8	109.596	O1	C3	H9	109.596
C2	O1	C3	112.072	C2	C4	H10	110.243
C2	C4	H12	110.226	C2	C4	H13	110.226
C3	C5	H11	110.243	C3	C5	H14	110.226
C3	C5	H15	110.226	C4	C2	H6	110.892
C4	C2	H7	110.892	C5	C3	H8	110.892
C5	C3	H9	110.892	H6	C2	H7	107.789
H8	C3	H9	107.789	H10	C4	H12	108.720
H10	C4	H13	108.720	H11	C5	H14	108.720
H11	C5	H15	108.720	H12	C4	H13	108.661
H14	C5	H15	108.661

All results from a given calculation for C₄H₁₀O (Ethoxy ethane)

using model chemistry: MP2/6-31+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 C4H10O (Ethoxy ethane)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for C₄H₁₀O (Ethoxy ethane)