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	hartrees
Energy at 0K	-336.638580
Energy at 298.15K	-336.645588
HF Energy	-336.638580
Nuclear repulsion energy	233.080753

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3721	3527	0.00
2	A_g	3572	3386	0.00
3	A_g	1832	1736	0.00
4	A_g	1645	1559	0.00
5	A_g	1430	1355	0.00
6	A_g	1140	1081	0.00
7	A_g	762	723	0.00
8	A_g	558	529	0.00
9	A_g	417	395	0.00
10	A_u	758	719	602.97
11	A_u	692	656	119.92
12	A_u	446	423	50.26
13	A_u	148	140	14.64
14	B_g	885	839	0.00
15	B_g	747	708	0.00
16	B_g	630	597	0.00
17	B_u	3721	3527	169.01
18	B_u	3573	3386	138.61
19	B_u	1807	1713	386.45
20	B_u	1657	1570	434.78
21	B_u	1360	1289	158.23
22	B_u	1136	1077	10.87
23	B_u	595	564	15.63
24	B_u	290	275	47.06

Atom	x (Å)	y (Å)
C1	-0.059	0.752
C2	0.059	-0.752
O3	-1.160	1.323
O4	1.160	-1.323
N5	1.160	1.322
N6	-1.160	-1.322
H7	1.233	2.328
H8	1.986	0.737
H9	-1.233	-2.328
H10	-1.986	-0.737

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5091	1.2399	2.4062	1.3450	2.3482	2.0372	2.0443	3.2963	2.4354
C2	1.5091		2.4062	1.2399	2.3482	1.3450	3.2963	2.4354	2.0372	2.0443
O3	1.2399	2.4062		3.5180	2.3195	2.6443	2.5951	3.1993	3.6511	2.2191
O4	2.4062	1.2399	3.5180		2.6443	2.3195	3.6511	2.2191	2.5951	3.1993
N5	1.3450	2.3482	2.3195	2.6443		3.5169	1.0087	1.0117	4.3639	3.7593
N6	2.3482	1.3450	2.6443	2.3195	3.5169		4.3639	3.7593	1.0087	1.0117
H7	2.0372	3.2963	2.5951	3.6511	1.0087	4.3639		1.7598	5.2682	4.4443
H8	2.0443	2.4354	3.1993	2.2191	1.0117	3.7593	1.7598		4.4443	4.2359
H9	3.2963	2.0372	3.6511	2.5951	4.3639	1.0087	5.2682	4.4443		1.7598
H10	2.4354	2.0443	2.2191	3.1993	3.7593	1.0117	4.4443	4.2359	1.7598

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	121.845	C1	C2	N6	110.587
C1	N5	H7	119.197	C1	N5	H8	119.654
C2	C1	O3	121.845	C2	C1	N5	110.587
C2	N6	H9	119.197	C2	N6	H10	119.654
O3	C1	N5	127.568	O4	C2	N6	127.568
H7	N5	H8	121.149	H9	N6	H10	121.149

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: wB97X-D/3-21G*

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	0.628
2	C	0.628
3	O	-0.535
4	O	-0.535
5	N	-0.806
6	N	-0.806
7	H	0.349
8	H	0.365
9	H	0.349
10	H	0.365

	x	y	z
x	6.813	0.385	0.000
y	0.385	5.249	0.000
z	0.000	0.000	1.676

<r²>	143.684
(<r²>)^1/2	11.987

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: wB97X-D/3-21G*

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)