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	hartrees
Energy at 0K	-378.389931
Energy at 298.15K	-378.393899
HF Energy	-378.389931
Nuclear repulsion energy	231.455370

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3478	3464	0.00
2	A_g	1744	1737	0.00
3	A_g	1376	1371	0.00
4	A_g	1166	1162	0.00
5	A_g	780	777	0.00
6	A_g	543	541	0.00
7	A_g	387	385	0.00
8	A_u	702	700	177.92
9	A_u	436	434	46.93
10	A_u	127	126	5.25
11	B_g	785	781	0.00
12	B_g	693	690	0.00
13	B_u	3480	3467	205.41
14	B_u	1774	1767	357.97
15	B_u	1300	1294	728.50
16	B_u	1142	1138	58.34
17	B_u	646	644	20.90
18	B_u	253	252	53.68

Atom	x (Å)	y (Å)
C1	-0.058	0.777
C2	0.058	-0.777
O3	1.137	1.391
O4	-1.137	-1.391
O5	-1.137	1.338
O6	1.137	-1.338
H7	1.811	0.670
H8	-1.811	-0.670

	C1	C2	O3	O4	O5	O6	H7	H8
C1		1.5582	1.3428	2.4217	1.2162	2.4286	1.8716	2.2735
C2	1.5582		2.4217	1.3428	2.4286	1.2162	2.2735	1.8716
O3	1.3428	2.4217		3.5928	2.2740	2.7288	0.9871	3.5969
O4	2.4217	1.3428	3.5928		2.7288	2.2740	3.5969	0.9871
O5	1.2162	2.4286	2.2740	2.7288		3.5110	3.0224	2.1181
O6	2.4286	1.2162	2.7288	2.2740	3.5110		2.1181	3.0224
H7	1.8716	2.2735	0.9871	3.5969	3.0224	2.1181		3.8621
H8	2.2735	1.8716	3.5969	0.9871	2.1181	3.0224	3.8621

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	112.979	C1	C2	O6	121.692
C1	O3	H7	105.877	C2	C1	O3	112.979
C2	C1	O5	121.692	C2	O4	H8	105.877
O3	C1	O5	125.329	O4	C2	O6	125.329

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

using model chemistry: BLYP/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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Number	Element	Mulliken
1	C	0.262
2	C	0.262
3	O	-0.235
4	O	-0.235
5	O	-0.285
6	O	-0.285
7	H	0.257
8	H	0.257

	x	y	z
x	6.787	-0.183	0.000
y	-0.183	5.138	0.000
z	0.000	0.000	2.611

<r²>	137.404
(<r²>)^1/2	11.722

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

using model chemistry: BLYP/6-311G**

States and conformations

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