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	hartrees
Energy at 0K	-264.108060
Energy at 298.15K	-264.116259
HF Energy	-263.127709
Nuclear repulsion energy	183.348917

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3742	3560	42.95
2	A	3676	3498	50.40
3	A	3615	3440	29.02
4	A	3189	3034	11.01
5	A	3132	2980	24.19
6	A	3066	2917	38.41
7	A	1799	1711	482.96
8	A	1632	1553	135.99
9	A	1543	1468	36.27
10	A	1512	1439	9.14
11	A	1499	1427	57.99
12	A	1455	1385	34.10
13	A	1416	1347	129.48
14	A	1219	1160	4.84
15	A	1168	1111	9.80
16	A	1149	1094	25.19
17	A	1083	1030	29.55
18	A	902	858	5.41
19	A	779	742	34.87
20	A	604	575	39.25
21	A	559	532	120.83
22	A	536	510	43.57
23	A	492	468	37.07
24	A	397	377	117.97
25	A	289	275	4.16
26	A	176	167	1.70
27	A	114	108	7.60

Atom	x (Å)	y (Å)	z (Å)
C1	-1.857	0.042	0.096
H2	-2.060	0.799	-0.661
H3	-2.675	-0.670	0.064
H4	-1.847	0.522	1.075
H5	-0.610	-1.659	-0.043
N6	-0.624	-0.664	-0.185
C7	0.622	-0.110	-0.021
H8	-0.085	1.766	-0.457
H9	1.555	1.648	-0.075
N10	0.630	1.273	0.049
O11	1.637	-0.782	0.074

	C1	H2	H3	H4	H5	N6	C7	H8	H9	N10	O11
C1		1.0898	1.0855	1.0901	2.1134	1.4481	2.4857	2.5334	3.7748	2.7747	3.5895
H2	1.0898		1.7501	1.7706	2.9199	2.1045	2.9030	2.2084	3.7593	2.8218	4.0873
H3	1.0855	1.7501		1.7690	2.2922	2.0666	3.3453	3.5941	4.8260	3.8338	4.3137
H4	1.0901	1.7706	1.7690		2.7451	2.1187	2.7737	2.6456	3.7635	2.7837	3.8520
H5	2.1134	2.9199	2.2922	2.7451		1.0054	1.9791	3.4899	3.9530	3.1844	2.4150
N6	1.4481	2.1045	2.0666	2.1187	1.0054		1.3729	2.5039	3.1788	2.3187	2.2786
C7	2.4857	2.9030	3.3453	2.7737	1.9791	1.3729		2.0520	1.9914	1.3847	1.2210
H8	2.5334	2.2084	3.5941	2.6456	3.4899	2.5039	2.0520		1.6882	1.0054	3.1209
H9	3.7748	3.7593	4.8260	3.7635	3.9530	3.1788	1.9914	1.6882		1.0063	2.4359
N10	2.7747	2.8218	3.8338	2.7837	3.1844	2.3187	1.3847	1.0054	1.0063		2.2883
O11	3.5895	4.0873	4.3137	3.8520	2.4150	2.2786	1.2210	3.1209	2.4359	2.2883

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N6	H5	117.814	C1	N6	C7	123.545
H2	C1	H3	107.131	H2	C1	H4	108.628
H2	C1	N6	111.258	H3	C1	H4	108.795
H3	C1	N6	108.458	H4	C1	N6	112.408
H5	N6	C7	111.712	N6	C7	N10	114.460
N6	C7	O11	122.804	C7	N10	H8	117.431
C7	N10	H9	111.817	H8	N10	H9	114.104
N10	C7	O11	122.729

All results from a given calculation for C₂H₆N₂O (Urea, methyl-)

using model chemistry: MP2/Def2TZVPP

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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All results from a given calculation for C2H6N2O (Urea, methyl-)

using model chemistry: MP2/Def2TZVPP

States and conformations

All results from a given calculation for C₂H₆N₂O (Urea, methyl-)