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	hartrees
Energy at 0K	-373.052811
Energy at 298.15K
HF Energy	-373.052811
Nuclear repulsion energy	232.098838

Atom	x (Å)	y (Å)
C1	-0.037	0.777
C2	0.037	-0.777
O3	1.231	1.254
O4	-1.231	-1.254
O5	-1.231	1.232
O6	1.231	-1.232
H7	1.672	0.238
H8	-1.672	-0.238

	C1	C2	O3	O4	O5	O6	H7	H8
C1		1.5549	1.3548	2.3555	1.2776	2.3754	1.7918	1.9238
C2	1.5549		2.3555	1.3548	2.3754	1.2776	1.9238	1.7918
O3	1.3548	2.3555		3.5143	2.4616	2.4863	1.1078	3.2635
O4	2.3555	1.3548	3.5143		2.4863	2.4616	3.2635	1.1078
O5	1.2776	2.3754	2.4616	2.4863		3.4831	3.0681	1.5348
O6	2.3754	1.2776	2.4863	2.4616	3.4831		1.5348	3.0681
H7	1.7918	1.9238	1.1078	3.2635	3.0681	1.5348		3.3772
H8	1.9238	1.7918	3.2635	1.1078	1.5348	3.0681	3.3772

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	107.904	C1	C2	O6	113.630
C1	O3	H7	92.818	C2	C1	O3	107.904
C2	C1	O5	113.630	C2	O4	H8	92.818
O3	C1	O5	138.467	O4	C2	O6	138.467

Number	Element	Mulliken
1	C	0.181
2	C	0.181
3	O	-0.199
4	O	-0.199
5	O	-0.204
6	O	-0.204
7	H	0.223
8	H	0.223

All results from a given calculation for C₂H₂O₄ (Oxalic Acid)

using model chemistry: B3PW91/STO-3G

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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<r²>	130.505
(<r²>)^1/2	11.424

All results from a given calculation for C2H2O4 (Oxalic Acid)

using model chemistry: B3PW91/STO-3G

States and conformations

All results from a given calculation for C₂H₂O₄ (Oxalic Acid)