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	hartrees
Energy at 0K	-225.150404
Energy at 298.15K
HF Energy	-224.902277
Nuclear repulsion energy	123.854072

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3791	3791	51.57
2	A₁	3659	3659	7.08
3	A₁	1812	1812	448.80
4	A₁	1640	1640	0.93
5	A₁	1154	1154	0.53
6	A₁	974	974	9.71
7	A₁	482	482	2.51
8	A₂	358	358	0.00
9	A₂	456i	456i	0.00
10	B₁	773	773	5.77
11	B₁	564	564	10.27
12	B₁	353i	353i	481.21
13	B₂	3789	3789	40.40
14	B₂	3650	3650	66.28
15	B₂	1635	1635	274.17
16	B₂	1431	1431	226.89
17	B₂	995	995	14.99
18	B₂	567	567	14.41

Atom	y (Å)	z (Å)
C1	0.000	0.145
O2	0.000	1.363
N3	1.157	-0.599
N4	-1.157	-0.599
H5	2.022	-0.091
H6	1.179	-1.601
H7	-2.022	-0.091
H8	-1.179	-1.601

	C1	O2	N3	N4	H5	H6	H7	H8
C1		1.2179	1.3754	1.3754	2.0354	2.1067	2.0354	2.1067
O2	1.2179		2.2773	2.2773	2.4899	3.1897	2.4899	3.1897
N3	1.3754	2.2773		2.3141	1.0028	1.0025	3.2191	2.5420
N4	1.3754	2.2773	2.3141		3.2191	2.5420	1.0028	1.0025
H5	2.0354	2.4899	1.0028	3.2191		1.7295	4.0434	3.5391
H6	2.1067	3.1897	1.0025	2.5420	1.7295		3.5391	2.3581
H7	2.0354	2.4899	3.2191	1.0028	4.0434	3.5391		1.7295
H8	2.1067	3.1897	2.5420	1.0025	3.5391	2.3581	1.7295

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	116.835	C1	N3	H6	123.983
C1	N4	H7	116.835	C1	N4	H8	123.983
O2	C1	N3	122.727	O2	C1	N4	122.727
N3	C1	N4	114.545	H5	N3	H6	119.181
H7	N4	H8	119.181

All results from a given calculation for NH₂CONH₂ (Urea)

using model chemistry: B2PLYP=FULL/6-311G**

States and conformations

Conformer 1 (C2)

Conformer 2 (CS)

Conformer 3 (C2V)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for NH2CONH2 (Urea)

using model chemistry: B2PLYP=FULL/6-311G**

States and conformations

Conformer 1 (C2)

Conformer 2 (CS)

Conformer 3 (C2V)

All results from a given calculation for NH₂CONH₂ (Urea)