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	hartrees
Energy at 0K	-224.704879
Energy at 298.15K
HF Energy	-224.005496
Nuclear repulsion energy	123.203079

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3791	3636
2	A₁	3648	3498
3	A₁	1831	1756
4	A₁	1612	1546
5	A₁	1140	1094
6	A₁	980	940
7	A₁	476	456
8	A₂	367	351
9	A₂	523i	502i
10	B₁	769	738
11	B₁	569	545
12	B₁	450i	431i
13	B₂	3789	3634
14	B₂	3640	3491
15	B₂	1621	1555
16	B₂	1438	1379
17	B₂	989	948
18	B₂	559	537

Atom	y (Å)	z (Å)
C1	0.000	0.148
O2	0.000	1.373
N3	1.159	-0.604
N4	-1.159	-0.604
H5	2.034	-0.097
H6	1.172	-1.614
H7	-2.034	-0.097
H8	-1.172	-1.614

	C1	O2	N3	N4	H5	H6	H7	H8
C1		1.2249	1.3817	1.3817	2.0485	2.1162	2.0485	2.1162
O2	1.2249		2.2915	2.2915	2.5095	3.2085	2.5095	3.2085
N3	1.3817	2.2915		2.3184	1.0108	1.0101	3.2329	2.5408
N4	1.3817	2.2915	2.3184		3.2329	2.5408	1.0108	1.0101
H5	2.0485	2.5095	1.0108	3.2329		1.7442	4.0676	3.5467
H6	2.1162	3.2085	1.0101	2.5408	1.7442		3.5467	2.3445
H7	2.0485	2.5095	3.2329	1.0108	4.0676	3.5467		1.7442
H8	2.1162	3.2085	2.5408	1.0101	3.5467	2.3445	1.7442

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	116.951	C1	N3	H6	123.708
C1	N4	H7	116.951	C1	N4	H8	123.708
O2	C1	N3	122.967	O2	C1	N4	122.967
N3	C1	N4	114.066	H5	N3	H6	119.341
H7	N4	H8	119.341

All results from a given calculation for NH₂CONH₂ (Urea)

using model chemistry: QCISD(T)=FULL/cc-pVDZ

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: QCISD(T)=FULL/cc-pVDZ

States and conformations

Conformer 1 (C2)

Conformer 2 (CS)

Conformer 3 (C2V)

All results from a given calculation for NH₂CONH₂ (Urea)