Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : XU1

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 23


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 -0.868 0.56 0.0010
2 C10 C C10 N Y N 0 3.364 0.907 0.0
3 C11 C C11 N Y N 0 2.582 2.052 0.0020
4 C12 C C12 N Y N 0 1.206 1.963 0.0010
5 C2 C C2 N Y N 0 -1.706 1.675 -0.0030
6 C3 C C3 N Y N 0 -3.075 1.464 -0.0040
7 C4 C C4 N Y N 0 -3.559 0.168 -0.0030
8 C5 C C5 N Y N 0 -1.429 -0.728 0.0020
9 C6 C C6 N N N 0 0.724 -1.764 0.0020
10 C7 C C7 N Y N 0 1.391 -0.454 0.0050
11 C8 C C8 N Y N 0 0.598 0.712 0.0030
12 C9 C C9 N Y N 0 2.78 -0.342 -0.0050
13 H1 H H1 N N N 0 3.055 3.023 0.0010
14 H2 H H2 N N N 0 0.603 2.859 -0.0010
15 H3 H H3 N N N 0 4.44 0.994 -0.0080
16 H4 H H4 N N N 0 3.396 -1.23 -0.0070
17 H5 H H5 N N N 0 -1.033 -2.724 0.01
18 H6 H H6 N N N 0 -4.627 0.0030 -0.0040
19 H7 H H7 N N N 0 -3.756 2.302 -0.0080
20 H8 H H8 N N N 0 -1.299 2.675 -0.0030
21 N1 N N1 N Y N 0 -2.748 -0.87 0.0
22 N2 N N2 N N N 0 -0.618 -1.847 0.013
23 O1 O O1 N N N 0 1.391 -2.782 -0.011