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	hartrees
Energy at 0K	-378.215190
Energy at 298.15K	-378.219339
HF Energy	-378.215190
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3742	3742	0.00
2	A_g	1914	1914	0.00
3	A_g	1506	1506	0.00
4	A_g	1261	1261	0.00
5	A_g	849	849	0.00
6	A_g	574	574	0.00
7	A_g	421	421	0.00
8	A_u	719	719	218.73
9	A_u	458	458	60.04
10	A_u	128	128	6.34
11	B_g	801	801	0.00
12	B_g	709	709	0.00
13	B_u	3746	3746	266.83
14	B_u	1929	1929	447.11
15	B_u	1381	1381	882.49
16	B_u	1255	1255	8.24
17	B_u	683	683	23.34
18	B_u	281	281	54.59

Atom	x (Å)	y (Å)
C1	-0.050	0.769
C2	0.050	-0.769
O3	1.123	1.368
O4	-1.123	-1.368
O5	-1.123	1.319
O6	1.123	-1.319
H7	1.799	0.667
H8	-1.799	-0.667

	C1	C2	O3	O4	O5	O6	H7	H8
C1		1.5414	1.3179	2.3916	1.2058	2.3952	1.8526	2.2632
C2	1.5414		2.3916	1.3179	2.3952	1.2058	2.2632	1.8526
O3	1.3179	2.3916		3.5408	2.2475	2.6871	0.9740	3.5618
O4	2.3916	1.3179	3.5408		2.6871	2.2475	3.5618	0.9740
O5	1.2058	2.3952	2.2475	2.6871		3.4650	2.9947	2.0978
O6	2.3952	1.2058	2.6871	2.2475	3.4650		2.0978	2.9947
H7	1.8526	2.2632	0.9740	3.5618	2.9947	2.0978		3.8383
H8	2.2632	1.8526	3.5618	0.9740	2.0978	2.9947	3.8383

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	113.300	C1	C2	O6	120.870
C1	O3	H7	106.909	C2	C1	O3	113.300
C2	C1	O5	120.870	C2	O4	H8	106.909
O3	C1	O5	125.830	O4	C2	O6	125.830

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

using model chemistry: wB97X-D/6-31G**

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	0.573
2	C	0.573
3	O	-0.478
4	O	-0.478
5	O	-0.465
6	O	-0.465
7	H	0.370
8	H	0.370

	x	y	z
x	6.185	-0.299	0.000
y	-0.299	4.505	0.000
z	0.000	0.000	2.346

<r²>	134.020
(<r²>)^1/2	11.577

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

using model chemistry: wB97X-D/6-31G**

States and conformations

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