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	hartrees
Energy at 0K	-338.517009
Energy at 298.15K	-338.523387
Nuclear repulsion energy	233.631816

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3763	3600	0.00
2	A_g	3609	3452	0.00
3	A_g	1831	1751	0.00
4	A_g	1595	1526	0.00
5	A_g	1430	1368	0.00
6	A_g	1096	1048	0.00
7	A_g	775	741	0.00
8	A_g	530	507	0.00
9	A_g	393	376	0.00
10	A_u	676	646	0.86
11	A_u	487	466	248.43
12	A_u	377	360	247.65
13	A_u	97	93	8.13
14	B_g	819	784	0.00
15	B_g	658	630	0.00
16	B_g	399	382	0.00
17	B_u	3764	3601	195.88
18	B_u	3609	3453	138.60
19	B_u	1807	1729	751.56
20	B_u	1586	1517	322.79
21	B_u	1326	1269	124.58
22	B_u	1085	1038	14.25
23	B_u	568	543	25.07
24	B_u	272	260	40.44

Atom	x (Å)	y (Å)
C1	-0.057	0.769
C2	0.057	-0.769
O3	-1.145	1.328
O4	1.145	-1.328
N5	1.145	1.362
N6	-1.145	-1.362
H7	1.213	2.366
H8	1.969	0.780
H9	-1.213	-2.366
H10	-1.969	-0.780

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5415	1.2230	2.4168	1.3408	2.3924	2.0409	2.0266	3.3408	2.4604
C2	1.5415		2.4168	1.2230	2.3924	1.3408	3.3408	2.4604	2.0409	2.0266
O3	1.2230	2.4168		3.5068	2.2901	2.6903	2.5762	3.1620	3.6946	2.2634
O4	2.4168	1.2230	3.5068		2.6903	2.2901	3.6946	2.2634	2.5762	3.1620
N5	1.3408	2.3924	2.2901	2.6903		3.5591	1.0059	1.0093	4.4113	3.7799
N6	2.3924	1.3408	2.6903	2.2901	3.5591		4.4113	3.7799	1.0059	1.0093
H7	2.0409	3.3408	2.5762	3.6946	1.0059	4.4113		1.7571	5.3176	4.4747
H8	2.0266	2.4604	3.1620	2.2634	1.0093	3.7799	1.7571		4.4747	4.2362
H9	3.3408	2.0409	3.6946	2.5762	4.4113	1.0059	5.3176	4.4747		1.7571
H10	2.4604	2.0266	2.2634	3.1620	3.7799	1.0093	4.4747	4.2362	1.7571

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	121.483	C1	C2	N6	112.018
C1	N5	H7	120.163	C1	N5	H8	118.476
C2	C1	O3	121.483	C2	C1	N5	112.018
C2	N6	H9	120.163	C2	N6	H10	118.476
O3	C1	N5	126.499	O4	C2	N6	126.499
H7	N5	H8	121.360	H9	N6	H10	121.360

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: B1B95/6-31+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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Number	Element	Mulliken
1	C	0.444
2	C	0.444
3	O	-0.571
4	O	-0.571
5	N	-0.550
6	N	-0.550
7	H	0.333
8	H	0.344
9	H	0.333
10	H	0.344

	x	y	z
x	8.676	0.308	0.000
y	0.308	7.115	0.000
z	0.000	0.000	4.204

<r²>	144.572
(<r²>)^1/2	12.024

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: B1B95/6-31+G**

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)