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	hartrees
Energy at 0K	-378.259500
Energy at 298.15K	-378.263651
HF Energy	-377.828168
Nuclear repulsion energy	234.441587

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3657	3495	0.00
2	A_g	1826	1745	0.00
3	A_g	1457	1393	0.00
4	A_g	1235	1180	0.00
5	A_g	831	795	0.00
6	A_g	568	543	0.00
7	A_g	410	392	0.00
8	A_u	720	688	182.81
9	A_u	469	448	48.38
10	A_u	127	122	6.14
11	B_g	843	806	0.00
12	B_g	718	686	0.00
13	B_u	3661	3499	262.67
14	B_u	1849	1767	414.03
15	B_u	1346	1287	799.03
16	B_u	1213	1159	17.32
17	B_u	676	646	21.46
18	B_u	266	254	55.00

Atom	x (Å)	y (Å)
C1	-0.054	0.766
C2	0.054	-0.766
O3	1.123	1.371
O4	-1.123	-1.371
O5	-1.123	1.319
O6	1.123	-1.319
H7	1.797	0.667
H8	-1.797	-0.667

	C1	C2	O3	O4	O5	O6	H7	H8
C1		1.5349	1.3234	2.3888	1.2042	2.3943	1.8532	2.2562
C2	1.5349		2.3888	1.3234	2.3943	1.2042	2.2562	1.8532
O3	1.3234	2.3888		3.5440	2.2468	2.6900	0.9738	3.5607
O4	2.3888	1.3234	3.5440		2.6900	2.2468	3.5607	0.9738
O5	1.2042	2.3943	2.2468	2.6900		3.4655	2.9918	2.0978
O6	2.3943	1.2042	2.6900	2.2468	3.4655		2.0978	2.9918
H7	1.8532	2.2562	0.9738	3.5607	2.9918	2.0978		3.8332
H8	2.2562	1.8532	3.5607	0.9738	2.0978	2.9918	3.8332

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	113.181	C1	C2	O6	121.411
C1	O3	H7	106.557	C2	C1	O3	113.181
C2	C1	O5	121.411	C2	O4	H8	106.557
O3	C1	O5	125.409	O4	C2	O6	125.409

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

using model chemistry: B2PLYP=FULL/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 C2H2O4 (Oxalic Acid)

using model chemistry: B2PLYP=FULL/cc-pVTZ

States and conformations

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