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	hartrees
Energy at 0K	-300.970978
Energy at 298.15K	-300.980828
HF Energy	-300.359689
Nuclear repulsion energy	245.283621

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3611	3448	26.86
2	A	3192	3047	1.06
3	A	3127	2985	0.38
4	A	3073	2934	1.24
5	A	1729	1651	117.48
6	A	1624	1551	24.14
7	A	1612	1539	0.18
8	A	1537	1468	16.41
9	A	1496	1428	59.00
10	A	1212	1158	5.37
11	A	1193	1139	0.03
12	A	1168	1115	1.98
13	A	917	876	7.14
14	A	505	482	2.39
15	A	245	234	1.57
16	A	229	218	8.78
17	A	169	161	0.23
18	A	76	72	4.40
19	B	3604	3441	7.73
20	B	3191	3047	0.44
21	B	3127	2986	92.65
22	B	3072	2933	120.75
23	B	1630	1557	23.49
24	B	1613	1540	11.26
25	B	1558	1487	324.59
26	B	1507	1439	19.44
27	B	1249	1193	405.92
28	B	1200	1145	2.78
29	B	1188	1134	45.66
30	B	1029	983	2.47
31	B	754	720	27.73
32	B	716	684	11.13
33	B	469	448	298.37
34	B	377	360	53.10
35	B	148	142	3.66
36	B	105	101	17.43

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.092
O2	0.000	0.000	1.348
N3	0.000	1.167	-0.668
N4	0.000	-1.167	-0.668
C5	-0.042	2.474	0.012
C6	0.042	-2.474	0.012
H7	-0.129	1.126	-1.671
H8	0.129	-1.126	-1.671
H9	0.797	3.108	-0.292
H10	-0.797	-3.108	-0.292
H11	0.032	2.255	1.079
H12	-0.032	-2.255	1.079
H13	-0.983	3.003	-0.181
H14	0.983	-3.003	-0.181

	C1	O2	N3	N4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
C1		1.2555	1.3925	1.3925	2.4756	2.4756	2.0961	2.0961	3.2318	3.2318	2.4619	2.4619	3.1716	3.1716
O2	1.2555		2.3290	2.3290	2.8116	2.8116	3.2244	3.2244	3.6037	3.6037	2.2713	2.2713	3.5100	3.5100
N3	1.3925	2.3290		2.3333	1.4744	3.7039	1.0120	2.5059	2.1322	4.3648	2.0589	3.8423	2.1392	4.3117
N4	1.3925	2.3290	2.3333		3.7039	1.4744	2.5059	1.0120	4.3648	2.1322	3.8423	2.0589	4.3117	2.1392
C5	2.4756	2.8116	1.4744	3.7039		4.9486	2.1582	3.9779	1.0951	5.6413	1.0916	4.8479	1.0963	5.5755
C6	2.4756	2.8116	3.7039	1.4744	4.9486		3.9779	2.1582	5.6413	1.0951	4.8479	1.0916	5.5755	1.0963
H7	2.0961	3.2244	1.0120	2.5059	2.1582	3.9779		2.2671	2.5860	4.5030	2.9773	4.3596	2.5441	4.5287
H8	2.0961	3.2244	2.5059	1.0120	3.9779	2.1582	2.2671		4.5030	2.5860	4.3596	2.9773	4.5287	2.5441
H9	3.2318	3.6037	2.1322	4.3648	1.0951	5.6413	2.5860	4.5030		6.4178	1.7871	5.5979	1.7861	6.1154
H10	3.2318	3.6037	4.3648	2.1322	5.6413	1.0951	4.5030	2.5860	6.4178		5.5979	1.7871	6.1154	1.7861
H11	2.4619	2.2713	2.0589	3.8423	1.0916	4.8479	2.9773	4.3596	1.7871	5.5979		4.5108	1.7825	5.4900
H12	2.4619	2.2713	3.8423	2.0589	4.8479	1.0916	4.3596	2.9773	5.5979	1.7871	4.5108		5.4900	1.7825
H13	3.1716	3.5100	2.1392	4.3117	1.0963	5.5755	2.5441	4.5287	1.7861	6.1154	1.7825	5.4900		6.3197
H14	3.1716	3.5100	4.3117	2.1392	5.5755	1.0963	4.5287	2.5441	6.1154	1.7861	5.4900	1.7825	6.3197

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	C5	119.394	C1	N3	H7	120.501
C1	N4	C6	119.394	C1	N4	H8	120.501
O2	C1	N3	123.092	O2	C1	N4	123.092
N3	C1	N4	113.815	N3	C5	H9	111.301
N3	C5	H11	105.749	N3	C5	H13	111.794
N4	C6	H10	111.301	N4	C6	H12	105.749
N4	C6	H14	111.794	C5	N3	H7	119.289
C6	N4	H8	119.289	H9	C5	H11	109.624
H9	C5	H13	109.180	H10	C6	H12	109.624
H10	C6	H14	109.180	H11	C5	H13	109.114
H12	C6	H14	109.114

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

using model chemistry: MP2=FULL/3-21G

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=FULL/3-21G

States and conformations

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