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	hartrees
Energy at 0K	-303.137314
Energy at 298.15K	-303.147672
HF Energy	-302.146358
Nuclear repulsion energy	248.605955

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3644	3454	26.98
2	A	3217	3049	10.77
3	A	3173	3008	7.71
4	A	3083	2922	4.52
5	A	1788	1695	250.17
6	A	1549	1469	12.98
7	A	1519	1439	0.17
8	A	1493	1416	11.37
9	A	1483	1406	2.72
10	A	1225	1161	0.05
11	A	1197	1134	0.01
12	A	1165	1105	8.36
13	A	939	890	0.58
14	A	596	565	138.45
15	A	468	443	21.11
16	A	229	217	3.39
17	A	201	191	1.12
18	A	130	123	0.74
19	B	3641	3452	12.37
20	B	3217	3049	6.24
21	B	3173	3008	41.25
22	B	3082	2922	92.69
23	B	1573	1491	302.79
24	B	1534	1454	12.16
25	B	1511	1432	80.68
26	B	1487	1410	11.97
27	B	1279	1213	219.71
28	B	1182	1120	43.43
29	B	1167	1106	0.41
30	B	1060	1005	1.49
31	B	769	728	52.70
32	B	750	711	6.87
33	B	535	507	100.40
34	B	328	311	35.62
35	B	149	141	0.77
36	B	124	117	6.73

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.092
O2	0.000	0.000	1.314
N3	0.000	1.158	-0.670
N4	0.000	-1.158	-0.670
C5	-0.285	2.407	0.022
C6	0.285	-2.407	0.022
H7	-0.450	1.061	-1.567
H8	0.450	-1.061	-1.567
H9	-0.131	3.230	-0.673
H10	0.131	-3.230	-0.673
H11	0.405	2.513	0.854
H12	-0.405	-2.513	0.854
H13	-1.303	2.447	0.415
H14	1.303	-2.447	0.415

	C1	O2	N3	N4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
C1		1.2221	1.3861	1.3861	2.4246	2.4246	2.0199	2.0199	3.3218	3.3218	2.6574	2.6574	2.7907	2.7907
O2	1.2221		2.2968	2.2968	2.7465	2.7465	3.1030	3.1030	3.7943	3.7943	2.5869	2.5869	2.9138	2.9138
N3	1.3861	2.2968		2.3168	1.4552	3.6428	1.0091	2.4359	2.0757	4.3903	2.0787	3.9958	2.1293	3.9837
N4	1.3861	2.2968	2.3168		3.6428	1.4552	2.4359	1.0091	4.3903	2.0757	3.9958	2.0787	3.9837	2.1293
C5	2.4246	2.7465	1.4552	3.6428		4.8472	2.0892	3.8846	1.0880	5.6947	1.0861	4.9915	1.0925	5.1216
C6	2.4246	2.7465	3.6428	1.4552	4.8472		3.8846	2.0892	5.6947	1.0880	4.9915	1.0861	5.1216	1.0925
H7	2.0199	3.1030	1.0091	2.4359	2.0892	3.8846		2.3047	2.3678	4.4213	2.9503	4.3173	2.5649	4.3938
H8	2.0199	3.1030	2.4359	1.0091	3.8846	2.0892	2.3047		4.4213	2.3678	4.3173	2.9503	4.3938	2.5649
H9	3.3218	3.7943	2.0757	4.3903	1.0880	5.6947	2.3678	4.4213		6.4652	1.7702	5.9491	1.7808	5.9552
H10	3.3218	3.7943	4.3903	2.0757	5.6947	1.0880	4.4213	2.3678	6.4652		5.9491	1.7702	5.9552	1.7808
H11	2.6574	2.5869	2.0787	3.9958	1.0861	4.9915	2.9503	4.3173	1.7702	5.9491		5.0914	1.7647	5.0595
H12	2.6574	2.5869	3.9958	2.0787	4.9915	1.0861	4.3173	2.9503	5.9491	1.7702	5.0914		5.0595	1.7647
H13	2.7907	2.9138	2.1293	3.9837	1.0925	5.1216	2.5649	4.3938	1.7808	5.9552	1.7647	5.0595		5.5437
H14	2.7907	2.9138	3.9837	2.1293	5.1216	1.0925	4.3938	2.5649	5.9552	1.7808	5.0595	1.7647	5.5437

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	C5	117.138	C1	N3	H7	114.064
C1	N4	C6	117.138	C1	N4	H8	114.064
O2	C1	N3	123.308	O2	C1	N4	123.308
N3	C1	N4	113.385	N3	C5	H9	108.547
N3	C5	H11	108.901	N3	C5	H13	112.619
N4	C6	H10	108.547	N4	C6	H12	108.901
N4	C6	H14	112.619	C5	N3	H7	114.737
C6	N4	H8	114.737	H9	C5	H11	109.017
H9	C5	H13	109.503	H10	C6	H12	109.017
H10	C6	H14	109.503	H11	C5	H13	108.196
H12	C6	H14	108.196

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

using model chemistry: MP2/TZVP

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/TZVP

States and conformations

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