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	hartrees
Energy at 0K	-338.402339
Energy at 298.15K	-338.408353
HF Energy	-338.402339
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3659	3587	0.00
2	A_g	3517	3448	0.00
3	A_g	1776	1741	0.00
4	A_g	1564	1533	0.00
5	A_g	1379	1352	0.00
6	A_g	1077	1056	0.00
7	A_g	745	731	0.00
8	A_g	514	504	0.00
9	A_g	379	371	0.00
10	A_u	678	665	0.47
11	A_u	455	446	146.43
12	A_u	298	292	380.89
13	A_u	84	82	0.04
14	B_g	791	776	0.00
15	B_g	661	648	0.00
16	B_g	292	286	0.00
17	B_u	3659	3587	129.42
18	B_u	3517	3448	86.62
19	B_u	1747	1713	501.15
20	B_u	1573	1542	309.02
21	B_u	1289	1264	120.69
22	B_u	1069	1048	9.26
23	B_u	557	546	19.26
24	B_u	259	254	38.98

Atom	x (Å)	y (Å)
C1	-0.063	0.774
C2	0.063	-0.774
O3	-1.155	1.348
O4	1.155	-1.348
N5	1.155	1.366
N6	-1.155	-1.366
H7	1.233	2.375
H8	1.979	0.774
H9	-1.233	-2.375
H10	-1.979	-0.774

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5539	1.2328	2.4468	1.3544	2.4030	2.0600	2.0419	3.3597	2.4627
C2	1.5539		2.4468	1.2328	2.4030	1.3544	3.3597	2.4627	2.0600	2.0419
O3	1.2328	2.4468		3.5494	2.3097	2.7140	2.5998	3.1854	3.7234	2.2758
O4	2.4468	1.2328	3.5494		2.7140	2.3097	3.7234	2.2758	2.5998	3.1854
N5	1.3544	2.4030	2.3097	2.7140		3.5781	1.0117	1.0147	4.4387	3.7946
N6	2.4030	1.3544	2.7140	2.3097	3.5781		4.4387	3.7946	1.0117	1.0147
H7	2.0600	3.3597	2.5998	3.7234	1.0117	4.4387		1.7660	5.3524	4.4980
H8	2.0419	2.4627	3.1854	2.2758	1.0147	3.7946	1.7660		4.4980	4.2490
H9	3.3597	2.0600	3.7234	2.5998	4.4387	1.0117	5.3524	4.4980		1.7660
H10	2.4627	2.0419	2.2758	3.1854	3.7946	1.0147	4.4980	4.2490	1.7660

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	121.969	C1	C2	N6	112.073
C1	N5	H7	118.977	C1	N5	H8	120.166
C2	C1	O3	121.969	C2	C1	N5	112.073
C2	N6	H9	118.977	C2	N6	H10	120.166
O3	C1	N5	125.959	O4	C2	N6	125.959
H7	N5	H8	120.857	H9	N6	H10	120.857

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: B97D3/6-31G*

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	0.523
2	C	0.523
3	O	-0.509
4	O	-0.509
5	N	-0.725
6	N	-0.725
7	H	0.346
8	H	0.365
9	H	0.346
10	H	0.365

	x	y	z
x	7.763	0.585	0.000
y	0.585	6.596	0.000
z	0.000	0.000	2.612

<r²>	145.755
(<r²>)^1/2	12.073

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: B97D3/6-31G*

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)