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	hartrees
Energy at 0K	-266.429969
Energy at 298.15K
HF Energy	-265.663472
Nuclear repulsion energy	162.821117

Atom	x (Å)	y (Å)
O1	1.330	0.340
H2	1.756	1.204
O3	-0.482	1.681
C4	0.000	0.572
C5	-0.808	-0.675
H6	-1.874	-0.502
C7	-0.282	-1.903
H8	0.785	-2.062
H9	-0.912	-2.780

	O1	H2	O3	C4	C5	H6	C7	H8	H9
O1		0.9635	2.2541	1.3501	2.3670	3.3132	2.7626	2.4630	3.8426
H2	0.9635		2.2883	1.8667	3.1793	4.0117	3.7164	3.4074	4.7956
O3	2.2541	2.2883		1.2093	2.3786	2.5898	3.5900	3.9518	4.4821
C4	1.3501	1.8667	1.2093		1.4859	2.1603	2.4912	2.7486	3.4741
C5	2.3670	3.1793	2.3786	1.4859		1.0798	1.3362	2.1128	2.1079
H6	3.3132	4.0117	2.5898	2.1603	1.0798		2.1206	3.0832	2.4725
C7	2.7626	3.7164	3.5900	2.4912	1.3362	2.1206		1.0794	1.0800
H8	2.4630	3.4074	3.9518	2.7486	2.1128	3.0832	1.0794		1.8436
H9	3.8426	4.7956	4.4821	3.4741	2.1079	2.4725	1.0800	1.8436

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	O3	123.362	O1	C4	C5	113.062
H2	O1	C4	106.372	O3	C4	C5	123.575
C4	C5	H6	113.758	C4	C5	C7	123.864
C5	C7	H8	121.642	C5	C7	H9	121.108
H6	C5	C7	122.379	H8	C7	H9	117.250

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

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 C3H4O2 (2-Propenoic acid)

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

States and conformations

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