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	hartrees
Energy at 0K	-56.593587
Energy at 298.15K	-56.603338
HF Energy	-56.049860
Nuclear repulsion energy	135.024868

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3651	3528	22.04
2	A	3188	3080	35.07
3	A	3140	3034	18.68
4	A	3040	2938	3.08
5	A	1658	1602	202.37
6	A	1552	1499	35.94
7	A	1518	1467	1.89
8	A	1500	1450	13.14
9	A	1479	1429	30.80
10	A	1205	1164	0.02
11	A	1170	1131	0.09
12	A	1158	1119	12.10
13	A	895	864	5.11
14	A	486	470	16.11
15	A	337	325	85.11
16	A	222	214	3.07
17	A	173	167	0.43
18	A	86	83	0.03
19	B	3648	3525	9.06
20	B	3188	3080	17.43
21	B	3141	3035	105.39
22	B	3039	2937	154.89
23	B	1569	1516	340.37
24	B	1536	1484	29.95
25	B	1509	1458	73.31
26	B	1487	1437	11.27
27	B	1289	1245	266.84
28	B	1171	1131	24.52
29	B	1167	1127	5.65
30	B	1026	991	1.37
31	B	702	678	31.65
32	B	689	666	12.61
33	B	465	449	278.09
34	B	320	309	37.61
35	B	123	119	16.16
36	B	92	89	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.082
O2	0.000	0.000	1.369
N3	0.000	1.194	-0.681
N4	0.000	-1.194	-0.681
C5	-0.075	2.512	0.020
C6	0.075	-2.512	0.020
H7	-0.289	1.149	-1.659
H8	0.289	-1.149	-1.659
H9	0.210	3.303	-0.702
H10	-0.210	-3.303	-0.702
H11	0.633	2.504	0.866
H12	-0.633	-2.504	0.866
H13	-1.092	2.716	0.420
H14	1.092	-2.716	0.420

	C1	O2	N3	N4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
C1		1.2871	1.4176	1.4176	2.5140	2.5140	2.1065	2.1065	3.4012	3.4012	2.6994	2.6994	2.9464	2.9464
O2	1.2871		2.3731	2.3731	2.8527	2.8527	3.2522	3.2522	3.9042	3.9042	2.6315	2.6315	3.0771	3.0771
N3	1.4176	2.3731		2.3889	1.4943	3.7729	1.0207	2.5561	2.1191	4.5024	2.1240	4.0591	2.1723	4.2065
N4	1.4176	2.3731	2.3889		3.7729	1.4943	2.5561	1.0207	4.5024	2.1191	4.0591	2.1240	4.2065	2.1723
C5	2.5140	2.8527	1.4943	3.7729		5.0264	2.1727	4.0444	1.1078	5.8611	1.1042	5.1177	1.1113	5.3714
C6	2.5140	2.8527	3.7729	1.4943	5.0264		4.0444	2.1727	5.8611	1.1078	5.1177	1.1042	5.3714	1.1113
H7	2.1065	3.2522	1.0207	2.5561	2.1727	4.0444		2.3702	2.4091	4.5549	3.0106	4.4550	2.7243	4.6009
H8	2.1065	3.2522	2.5561	1.0207	4.0444	2.1727	2.3702		4.5549	2.4091	4.4550	3.0106	4.6009	2.7243
H9	3.4012	3.9042	2.1191	4.5024	1.1078	5.8611	2.4091	4.5549		6.6193	1.8099	6.0740	1.8162	6.1854
H10	3.4012	3.9042	4.5024	2.1191	5.8611	1.1078	4.5549	2.4091	6.6193		6.0740	1.8099	6.1854	1.8162
H11	2.6994	2.6315	2.1240	4.0591	1.1042	5.1177	3.0106	4.4550	1.8099	6.0740		5.1660	1.7943	5.2590
H12	2.6994	2.6315	4.0591	2.1240	5.1177	1.1042	4.4550	3.0106	6.0740	1.8099	5.1660		5.2590	1.7943
H13	2.9464	3.0771	2.1723	4.2065	1.1113	5.3714	2.7243	4.6009	1.8162	6.1854	1.7943	5.2590		5.8540
H14	2.9464	3.0771	4.2065	2.1723	5.3714	1.1113	4.6009	2.7243	6.1854	1.8162	5.2590	1.7943	5.8540

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	C5	119.369	C1	N3	H7	118.614
C1	N4	C6	119.369	C1	N4	H8	118.614
O2	C1	N3	122.585	O2	C1	N4	122.585
N3	C1	N4	114.829	N3	C5	H9	108.136
N3	C5	H11	108.726	N3	C5	H13	112.130
N4	C6	H10	108.136	N4	C6	H12	108.726
N4	C6	H14	112.130	C5	N3	H7	118.292
C6	N4	H8	118.292	H9	C5	H11	109.809
H9	C5	H13	109.854	H10	C6	H12	109.809
H10	C6	H14	109.854	H11	C5	H13	108.167
H12	C6	H14	108.167

All results from a given calculation for NH(CH₃)CONH(CH₃) (Urea, N,N'-dimethyl-)

using model chemistry: MP2/CEP-31G

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 NH(CH3)CONH(CH3) (Urea, N,N'-dimethyl-)

using model chemistry: MP2/CEP-31G

States and conformations

All results from a given calculation for NH(CH₃)CONH(CH₃) (Urea, N,N'-dimethyl-)