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PDBeChem : Atoms of Molecule
Molecule : QM6
Atoms of a chemical element, that composes a molecule
Total Number of Atoms: 48
Record |
Atom Name |
Symbol |
PDB Name |
Stereochemistry |
Is Aromatic |
Is Leaving Atom |
Charge |
X-Coordinate |
Y-Coordinate |
Z-Coordinate |
1 |
C18 |
C |
C1 |
N |
Y |
N |
0 |
-1.791 |
2.579 |
-1.197 |
2 |
C17 |
C |
C2 |
N |
Y |
N |
0 |
-0.828 |
1.641 |
-0.817 |
3 |
C15 |
C |
C3 |
N |
N |
N |
0 |
0.597 |
2.021 |
-0.772 |
4 |
C13 |
C |
C4 |
N |
N |
N |
0 |
2.94 |
1.492 |
-0.362 |
5 |
C12 |
C |
C5 |
N |
Y |
N |
0 |
3.762 |
0.307 |
0.075 |
6 |
C11 |
C |
C6 |
N |
Y |
N |
0 |
4.364 |
-0.711 |
-0.786 |
7 |
C10 |
C |
C7 |
N |
Y |
N |
0 |
4.391 |
-0.927 |
-2.166 |
8 |
C20 |
C |
C8 |
N |
Y |
N |
0 |
-3.506 |
0.931 |
-0.888 |
9 |
C19 |
C |
C9 |
N |
Y |
N |
0 |
-3.121 |
2.224 |
-1.231 |
10 |
C02 |
C |
C10 |
N |
N |
N |
0 |
3.714 |
0.72 |
2.549 |
11 |
C04 |
C |
C11 |
N |
Y |
N |
0 |
4.1 |
-0.029 |
1.347 |
12 |
C06 |
C |
C12 |
N |
Y |
N |
0 |
5.027 |
-1.6 |
0.081 |
13 |
C07 |
C |
C13 |
N |
Y |
N |
0 |
5.7 |
-2.692 |
-0.455 |
14 |
C08 |
C |
C14 |
N |
Y |
N |
0 |
5.711 |
-2.89 |
-1.819 |
15 |
C09 |
C |
C15 |
N |
Y |
N |
0 |
5.063 |
-2.005 |
-2.669 |
16 |
C22 |
C |
C16 |
N |
N |
N |
0 |
-5.338 |
-0.318 |
-0.038 |
17 |
C25 |
C |
C17 |
N |
N |
N |
0 |
-7.139 |
-1.713 |
0.825 |
18 |
C26 |
C |
C18 |
N |
N |
N |
0 |
-8.541 |
-1.462 |
1.386 |
19 |
C27 |
C |
C19 |
N |
N |
N |
0 |
-8.31 |
-2.59 |
0.377 |
20 |
C28 |
C |
C20 |
N |
Y |
N |
0 |
-2.548 |
-0.009 |
-0.521 |
21 |
C29 |
C |
C21 |
N |
Y |
N |
0 |
-1.218 |
0.342 |
-0.479 |
22 |
N14 |
N |
N1 |
N |
N |
N |
0 |
1.525 |
1.115 |
-0.406 |
23 |
N21 |
N |
N2 |
N |
N |
N |
0 |
-4.853 |
0.574 |
-0.924 |
24 |
N24 |
N |
N3 |
N |
N |
N |
0 |
-6.612 |
-0.744 |
-0.139 |
25 |
O01 |
O |
O1 |
N |
N |
N |
0 |
3.04 |
1.726 |
2.448 |
26 |
O03 |
O |
O2 |
N |
N |
N |
0 |
4.108 |
0.291 |
3.766 |
27 |
O05 |
O |
O3 |
N |
Y |
N |
0 |
4.843 |
-1.156 |
1.339 |
28 |
O16 |
O |
O4 |
N |
N |
N |
0 |
0.935 |
3.151 |
-1.066 |
29 |
O23 |
O |
O5 |
N |
N |
N |
0 |
-4.625 |
-0.738 |
0.854 |
30 |
H181 |
H |
H1 |
N |
N |
N |
0 |
-1.494 |
3.584 |
-1.458 |
31 |
H132 |
H |
H2 |
N |
N |
N |
0 |
3.076 |
2.309 |
0.346 |
32 |
H131 |
H |
H3 |
N |
N |
N |
0 |
3.262 |
1.812 |
-1.353 |
33 |
H101 |
H |
H4 |
N |
N |
N |
0 |
3.882 |
-0.246 |
-2.832 |
34 |
H191 |
H |
H5 |
N |
N |
N |
0 |
-3.866 |
2.948 |
-1.524 |
35 |
H071 |
H |
H6 |
N |
N |
N |
0 |
6.214 |
-3.383 |
0.197 |
36 |
H081 |
H |
H7 |
N |
N |
N |
0 |
6.236 |
-3.739 |
-2.231 |
37 |
H091 |
H |
H8 |
N |
N |
N |
0 |
5.084 |
-2.174 |
-3.736 |
38 |
H251 |
H |
H9 |
N |
N |
N |
0 |
-6.403 |
-2.16 |
1.493 |
39 |
H261 |
H |
H10 |
N |
N |
N |
0 |
-8.726 |
-1.744 |
2.422 |
40 |
H262 |
H |
H11 |
N |
N |
N |
0 |
-9.071 |
-0.576 |
1.037 |
41 |
H271 |
H |
H12 |
N |
N |
N |
0 |
-8.689 |
-2.445 |
-0.635 |
42 |
H272 |
H |
H13 |
N |
N |
N |
0 |
-8.344 |
-3.613 |
0.751 |
43 |
H281 |
H |
H14 |
N |
N |
N |
0 |
-2.85 |
-1.011 |
-0.255 |
44 |
H291 |
H |
H15 |
N |
N |
N |
0 |
-0.476 |
-0.386 |
-0.185 |
45 |
H141 |
H |
H16 |
N |
N |
N |
0 |
1.256 |
0.213 |
-0.171 |
46 |
H211 |
H |
H17 |
N |
N |
N |
0 |
-5.442 |
0.967 |
-1.587 |
47 |
H241 |
H |
H18 |
N |
N |
N |
0 |
-7.181 |
-0.409 |
-0.849 |
48 |
H1 |
H |
H19 |
N |
N |
N |
0 |
3.83 |
0.817 |
4.528 |
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