Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 0X5

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 36


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N Y N 0 5.755 -0.727 -0.324
2 C11 C C11 N Y N 0 -0.316 0.838 1.06
3 C12 C C12 N Y N 0 -0.856 1.841 1.865
4 C13 C C13 N Y N 0 -2.226 1.975 1.946
5 C15 C C15 N Y N 0 -2.556 0.203 0.499
6 C16 C C16 N Y N 0 -1.189 0.0020 0.37
7 C18 C C18 N N N 0 -4.766 -0.376 -0.147
8 C2 C C2 N Y N 0 4.882 -1.683 0.163
9 C20 C C20 N N N 0 -5.714 -1.202 -0.978
10 C21 C C21 N N N 0 -7.205 -0.867 -0.892
11 C22 C C22 N N N 0 -6.411 -0.511 -2.151
12 C3 C C3 N Y N 0 3.528 -1.419 0.223
13 C4 C C4 N Y N 0 3.04 -0.183 -0.209
14 C5 C C5 N Y N 0 3.928 0.775 -0.706
15 C6 C C6 N Y N 0 5.28 0.497 -0.759
16 C8 C C8 N N N 0 1.594 0.106 -0.149
17 CL1 CL CL1 N N N 0 3.334 2.312 -1.253
18 CL2 CL CL2 N N N 0 2.434 -2.62 0.836
19 H1 H H1 N N N 0 5.967 1.236 -1.143
20 H10 H H10 N N N 0 -7.911 -1.694 -0.959
21 H11 H H11 N N N 0 -7.499 -0.048 -0.235
22 H12 H H12 N N N 0 -6.184 0.541 -2.323
23 H13 H H13 N N N 0 -6.596 -1.104 -3.047
24 H2 H H2 N N N 0 -0.209 2.505 2.419
25 H3 H H3 N N N 0 -2.65 2.749 2.568
26 H4 H H4 N N N 0 6.813 -0.939 -0.369
27 H5 H H5 N N N 0 5.261 -2.636 0.501
28 H6 H H6 N N N 0 1.645 0.965 1.674
29 H7 H H7 N N N 0 -0.808 -0.785 -0.263
30 H8 H H8 N N N 0 -3.107 -1.384 -0.69
31 H9 H H9 N N N 0 -5.44 -2.25 -1.101
32 N10 N N10 N N N 0 1.065 0.673 0.954
33 N14 N N14 N Y N 0 -3.027 1.168 1.275
34 N17 N N17 N N N 0 -3.443 -0.627 -0.186
35 O19 O O19 N N N 0 -5.194 0.515 0.556
36 O9 O O9 N N N 0 0.879 -0.166 -1.094