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	hartrees
Energy at 0K	-338.436146
Energy at 298.15K	-338.442335
HF Energy	-338.436146
Nuclear repulsion energy	231.422469

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3678	3615	0.00
2	A_g	3525	3465	0.00
3	A_g	1743	1713	0.00
4	A_g	1558	1531	0.00
5	A_g	1372	1348	0.00
6	A_g	1075	1056	0.00
7	A_g	744	731	0.00
8	A_g	513	504	0.00
9	A_g	391	385	0.00
10	A_u	662	651	0.35
11	A_u	457	449	171.18
12	A_u	347	341	295.88
13	A_u	87	85	6.27
14	B_g	792	779	0.00
15	B_g	645	634	0.00
16	B_g	356	350	0.00
17	B_u	3679	3616	156.25
18	B_u	3525	3464	94.94
19	B_u	1717	1688	654.34
20	B_u	1566	1539	281.17
21	B_u	1280	1258	136.88
22	B_u	1065	1046	6.49
23	B_u	562	552	22.00
24	B_u	270	266	38.20

Atom	x (Å)	y (Å)
C1	-0.059	0.775
C2	0.059	-0.775
O3	-1.153	1.348
O4	1.153	-1.348
N5	1.153	1.377
N6	-1.153	-1.377
H7	1.216	2.386
H8	1.986	0.799
H9	-1.216	-2.386
H10	-1.986	-0.799

	C1	C2	O3	O4	N5	N6	H7	H8	H9	H10
C1		1.5555	1.2347	2.4455	1.3537	2.4148	2.0542	2.0455	3.3664	2.4885
C2	1.5555		2.4455	1.2347	2.4148	1.3537	3.3664	2.4885	2.0542	2.0455
O3	1.2347	2.4455		3.5482	2.3064	2.7257	2.5862	3.1868	3.7349	2.3035
O4	2.4455	1.2347	3.5482		2.7257	2.3064	3.7349	2.3035	2.5862	3.1868
N5	1.3537	2.4148	2.3064	2.7257		3.5928	1.0106	1.0138	4.4470	3.8201
N6	2.4148	1.3537	2.7257	2.3064	3.5928		4.4470	3.8201	1.0106	1.0138
H7	2.0542	3.3664	2.5862	3.7349	1.0106	4.4470		1.7638	5.3559	4.5165
H8	2.0455	2.4885	3.1868	2.3035	1.0138	3.8201	1.7638		4.5165	4.2818
H9	3.3664	2.0542	3.7349	2.5862	4.4470	1.0106	5.3559	4.5165		1.7638
H10	2.4885	2.0455	2.3035	3.1868	3.8201	1.0138	4.5165	4.2818	1.7638

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	121.680	C1	C2	N6	112.698
C1	N5	H7	118.923	C1	N5	H8	120.253
C2	C1	O3	121.680	C2	C1	N5	112.698
C2	N6	H9	118.923	C2	N6	H10	120.253
O3	C1	N5	125.623	O4	C2	N6	125.623
H7	N5	H8	120.824	H9	N6	H10	120.824

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)

using model chemistry: B97D3/6-31+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	0.407
2	C	0.407
3	O	-0.548
4	O	-0.548
5	N	-0.520
6	N	-0.520
7	H	0.326
8	H	0.336
9	H	0.326
10	H	0.336

	x	y	z
x	9.122	0.402	0.000
y	0.402	7.726	0.000
z	0.000	0.000	4.427

<r²>	147.205
(<r²>)^1/2	12.133

All results from a given calculation for C2H4N2O2 (Oxalamide)

using model chemistry: B97D3/6-31+G**

States and conformations

All results from a given calculation for C₂H₄N₂O₂ (Oxalamide)