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	hartrees
Energy at 0K	-266.698978
Energy at 298.15K
HF Energy	-265.756740
Nuclear repulsion energy	162.875824

Atom	x (Å)	y (Å)
O1	1.334	0.326
H2	1.745	1.203
O3	-0.465	1.684
C4	0.000	0.565
C5	-0.814	-0.666
H6	-1.880	-0.495
C7	-0.295	-1.896
H8	0.774	-2.047
H9	-0.936	-2.766

	O1	H2	O3	C4	C5	H6	C7	H8	H9
O1		0.9681	2.2537	1.3551	2.3659	3.3170	2.7557	2.4391	3.8357
H2	0.9681		2.2615	1.8576	3.1685	4.0025	3.7103	3.3924	4.7891
O3	2.2537	2.2615		1.2116	2.3758	2.5981	3.5843	3.9317	4.4748
C4	1.3551	1.8576	1.2116		1.4759	2.1582	2.4791	2.7249	3.4601
C5	2.3659	3.1685	2.3758	1.4759		1.0797	1.3350	2.1043	2.1034
H6	3.3170	4.0025	2.5981	2.1582	1.0797		2.1153	3.0742	2.4594
C7	2.7557	3.7103	3.5843	2.4791	1.3350	2.1153		1.0795	1.0800
H8	2.4391	3.3924	3.9317	2.7249	2.1043	3.0742	1.0795		1.8540
H9	3.8357	4.7891	4.4748	3.4601	2.1034	2.4594	1.0800	1.8540

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	O3	122.723	O1	C4	C5	113.308
H2	O1	C4	104.956	O3	C4	C5	123.969
C4	C5	H6	114.347	C4	C5	C7	123.682
C5	C7	H8	120.911	C5	C7	H9	120.780
H6	C5	C7	121.972	H8	C7	H9	118.309

All results from a given calculation for C₃H₄O₂ (2-Propenoic acid)

using model chemistry: MP2/cc-pVTZ

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 C3H4O2 (2-Propenoic acid)

using model chemistry: MP2/cc-pVTZ

States and conformations

All results from a given calculation for C₃H₄O₂ (2-Propenoic acid)