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	hartrees
Energy at 0K	-307.138084
Energy at 298.15K
HF Energy	-305.952443
Nuclear repulsion energy	243.065751

Atom	x (Å)	y (Å)	z (Å)
C1	-2.315	0.045	0.000
C2	-0.909	-0.515	0.000
O3	0.000	0.494	0.000
O4	-0.610	-1.692	0.000
C5	1.376	0.054	0.000
C6	2.240	1.302	0.000
H7	-3.032	-0.778	0.000
H8	-2.459	0.673	0.885
H9	-2.459	0.673	-0.885
H10	1.553	-0.567	0.886
H11	1.553	-0.567	-0.886
H12	3.300	1.020	0.000
H13	2.038	1.908	-0.890
H14	2.038	1.908	0.890

	C1	C2	O3	O4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
C1		1.5129	2.3581	2.4334	3.6907	4.7251	1.0919	1.0952	1.0952	4.0145	4.0145	5.6986	4.8177	4.8177
C2	1.5129		1.3587	1.2137	2.3551	3.6360	2.1393	2.1442	2.1442	2.6171	2.6171	4.4804	3.9180	3.9180
O3	2.3581	1.3587		2.2691	1.4445	2.3811	3.2886	2.6196	2.6196	2.0788	2.0788	3.3413	2.6350	2.6350
O4	2.4334	1.2137	2.2691		2.6439	4.1330	2.5890	3.1297	3.1297	2.5934	2.5934	4.7579	4.5561	4.5561
C5	3.6907	2.3551	1.4445	2.6439		1.5177	4.4862	3.9841	3.9841	1.0963	1.0963	2.1527	2.1602	2.1602
C6	4.7251	3.6360	2.3811	4.1330	1.5177		5.6679	4.8227	4.8227	2.1794	2.1794	1.0965	1.0953	1.0953
H7	1.0919	2.1393	3.2886	2.5890	4.4862	5.6679		1.7944	1.7944	4.6747	4.6747	6.5825	5.8066	5.8066
H8	1.0952	2.1442	2.6196	3.1297	3.9841	4.8227	1.7944		1.7704	4.1990	4.5572	5.8366	4.9896	4.6633
H9	1.0952	2.1442	2.6196	3.1297	3.9841	4.8227	1.7944	1.7704		4.5572	4.1990	5.8366	4.6633	4.9896
H10	4.0145	2.6171	2.0788	2.5934	1.0963	2.1794	4.6747	4.1990	4.5572		1.7719	2.5211	3.0844	2.5220
H11	4.0145	2.6171	2.0788	2.5934	1.0963	2.1794	4.6747	4.5572	4.1990	1.7719		2.5211	2.5220	3.0844
H12	5.6986	4.4804	3.3413	4.7579	2.1527	1.0965	6.5825	5.8366	5.8366	2.5211	2.5211		1.7809	1.7809
H13	4.8177	3.9180	2.6350	4.5561	2.1602	1.0953	5.8066	4.9896	4.6633	3.0844	2.5220	1.7809		1.7795
H14	4.8177	3.9180	2.6350	4.5561	2.1602	1.0953	5.8066	4.6633	4.9896	2.5220	3.0844	1.7809	1.7795

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	110.287	C1	C2	O4	126.013
C2	C1	H7	109.360	C2	C1	H8	109.555
C2	C1	H9	109.555	C2	O3	C5	114.279
O3	C2	O4	123.700	O3	C5	C6	106.969
O3	C5	H10	109.038	O3	C5	H11	109.038
C5	C6	H12	109.814	C5	C6	H13	110.479
C5	C6	H14	110.479	C6	C5	H10	111.959
C6	C5	H11	111.959	H7	C1	H8	110.253
H7	C1	H9	110.253	H8	C1	H9	107.842
H10	C5	H11	107.820	H12	C6	H13	108.687
H12	C6	H14	108.687	H13	C6	H14	108.646

All results from a given calculation for C₄H₈O₂ (Ethyl acetate)

using model chemistry: MP4=FULL/6-311G**

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 C4H8O2 (Ethyl acetate)

using model chemistry: MP4=FULL/6-311G**

States and conformations

All results from a given calculation for C₄H₈O₂ (Ethyl acetate)