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	hartrees
Energy at 0K	-259.605125
Energy at 298.15K	-259.613271
Nuclear repulsion energy	179.455763

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4145	3384	2.00
2	A	4023	3285	1.61
3	A	3949	3224	5.74
4	A	3755	3066	0.09
5	A	3720	3037	3.01
6	A	3551	2899	5.85
7	A	2134	1742	137.43
8	A	1946	1589	22.95
9	A	1823	1489	3.11
10	A	1808	1476	7.88
11	A	1747	1426	4.97
12	A	1704	1391	4.43
13	A	1568	1280	167.50
14	A	1380	1127	0.81
15	A	1335	1090	20.25
16	A	1310	1070	25.58
17	A	1219	996	17.27
18	A	1005	820	13.22
19	A	908	741	193.56
20	A	859	701	81.33
21	A	703	574	74.22
22	A	561	458	25.26
23	A	506	413	6.15
24	A	374	305	43.43
25	A	292	239	7.38
26	A	179	146	1.77
27	A	98	80	3.73

Atom	x (Å)	y (Å)	z (Å)
C1	1.849	0.106	0.241
H2	1.847	-0.063	1.321
H3	2.776	-0.290	-0.171
H4	1.822	1.179	0.062
H5	0.776	-1.572	-0.341
N6	0.713	-0.550	-0.451
C7	-0.616	-0.144	-0.041
H8	-0.330	1.747	-0.775
H9	-1.775	1.522	0.032
N10	-0.774	1.291	0.033
O11	-1.511	-0.935	0.200

	C1	H2	H3	H4	H5	N6	C7	H8	H9	N10	O11
C1		1.0928	1.0891	1.0875	2.0755	1.4833	2.4938	2.9108	3.8967	2.8852	3.5174
H2	1.0928		1.7719	1.7682	2.4874	2.1590	2.8156	3.5224	4.1585	3.2184	3.6454
H3	1.0891	1.7719		1.7665	2.3820	2.0982	3.3978	3.7632	4.9031	3.8911	4.3506
H4	1.0875	1.7682	1.7665		2.9705	2.1172	2.7761	2.3785	3.6141	2.5984	3.9489
H5	2.0755	2.4874	2.3820	2.9705		1.0295	2.0164	3.5248	4.0276	3.2768	2.4343
N6	1.4833	2.1590	2.0982	2.1172	1.0295		1.4488	2.5434	3.2741	2.4153	2.3484
C7	2.4938	2.8156	3.3978	2.7761	2.0164	1.4488		2.0485	2.0314	1.4459	1.2178
H8	2.9108	3.5224	3.7632	2.3785	3.5248	2.5434	2.0485		1.6705	1.0281	3.0878
H9	3.8967	4.1585	4.9031	3.6141	4.0276	3.2741	2.0314	1.6705		1.0281	2.4771
N10	2.8852	3.2184	3.8911	2.5984	3.2768	2.4153	1.4459	1.0281	1.0281		2.3508
O11	3.5174	3.6454	4.3506	3.9489	2.4343	2.3484	1.2178	3.0878	2.4771	2.3508

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N6	H5	110.057	C1	N6	C7	116.532
H2	C1	H3	108.605	H2	C1	H4	108.380
H2	C1	N6	113.005	H3	C1	H4	108.498
H3	C1	N6	108.329	H4	C1	N6	109.927
H5	N6	C7	107.697	N6	C7	N10	113.106
N6	C7	O11	123.215	C7	N10	H8	110.651
C7	N10	H9	109.221	H8	N10	H9	108.665
N10	C7	O11	123.674

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

using model chemistry: HF/STO-3G

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: HF/STO-3G

States and conformations

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