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	hartrees
Energy at 0K	-338.247425
Energy at 298.15K	-338.253591
Nuclear repulsion energy	231.738185

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3658	3608	0.00
2	A_g	3495	3447	0.00
3	A_g	1774	1750	0.00
4	A_g	1530	1509	0.00
5	A_g	1364	1345	0.00
6	A_g	1066	1051	0.00
7	A_g	747	736	0.00
8	A_g	515	508	0.00
9	A_g	382	377	0.00
10	A_u	681	671	0.02
11	A_u	466	459	184.36
12	A_u	327	323	298.02
13	A_u	100	98	0.98
14	B_g	783	772	0.00
15	B_g	667	658	0.00
16	B_g	337	333	0.00
17	B_u	3659	3608	154.21
18	B_u	3495	3447	93.17
19	B_u	1749	1725	475.45
20	B_u	1534	1513	343.69
21	B_u	1279	1261	78.80
22	B_u	1061	1047	15.61
23	B_u	549	542	16.72
24	B_u	269	266	41.40

Atom	x (Å)	y (Å)
C1	-0.063	0.773
C2	0.063	-0.773
O3	-1.159	1.346
O4	1.159	-1.346
N5	1.159	1.356
N6	-1.159	-1.356
H7	1.250	2.366
H8	1.970	0.740
H9	-1.250	-2.366
H10	-1.970	-0.740

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5516	1.2368	2.4461	1.3537	2.3952	2.0644	2.0333	3.3567	2.4348
C2	1.5516		2.4461	1.2368	2.3952	1.3537	3.3567	2.4348	2.0644	2.0333
O3	1.2368	2.4461		3.5524	2.3180	2.7023	2.6162	3.1875	3.7135	2.2379
O4	2.4461	1.2368	3.5524		2.7023	2.3180	3.7135	2.2379	2.6162	3.1875
N5	1.3537	2.3952	2.3180	2.7023		3.5682	1.0142	1.0191	4.4343	3.7665
N6	2.3952	1.3537	2.7023	2.3180	3.5682		4.4343	3.7665	1.0142	1.0191
H7	2.0644	3.3567	2.6162	3.7135	1.0142	4.4343		1.7791	5.3526	4.4742
H8	2.0333	2.4348	3.1875	2.2379	1.0191	3.7665	1.7791		4.4742	4.2092
H9	3.3567	2.0644	3.7135	2.6162	4.4343	1.0142	5.3526	4.4742		1.7791
H10	2.4348	2.0333	2.2379	3.1875	3.7665	1.0191	4.4742	4.2092	1.7791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	122.221	C1	C2	N6	110.879
C1	N5	H7	120.664	C1	N5	H8	117.247
C2	C1	O3	122.221	C2	C1	N5	110.879
C2	N6	H9	120.664	C2	N6	H10	117.247
O3	C1	N5	126.900	O4	C2	N6	126.900
H7	N5	H8	122.088	H9	N6	H10	122.088

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: PBEPBE/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	0.491
2	C	0.491
3	O	-0.493
4	O	-0.493
5	N	-0.578
6	N	-0.578
7	H	0.283
8	H	0.298
9	H	0.283
10	H	0.298

	x	y	z
x	7.900	0.635	0.000
y	0.635	6.713	0.000
z	0.000	0.000	2.651

<r²>	145.452
(<r²>)^1/2	12.060

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: PBEPBE/6-31G**

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)