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PDBeChem : Atoms of Molecule
Molecule : POH
Atoms of a chemical element, that composes a molecule
Total Number of Atoms: 90
Record |
Atom Name |
Symbol |
PDB Name |
Stereochemistry |
Is Aromatic |
Is Leaving Atom |
Charge |
X-Coordinate |
Y-Coordinate |
Z-Coordinate |
1 |
CX3 |
C |
CX3 |
N |
Y |
N |
0 |
-3.518 |
6.091 |
1.189 |
2 |
C2A |
C |
C2A |
N |
Y |
N |
0 |
1.456 |
3.961 |
-0.04 |
3 |
C71 |
C |
C71 |
N |
Y |
N |
0 |
-2.785 |
4.092 |
0.089 |
4 |
C81 |
C |
C81 |
N |
Y |
N |
0 |
-3.637 |
4.426 |
-0.972 |
5 |
C91 |
C |
C91 |
N |
Y |
N |
0 |
-4.386 |
5.582 |
-0.89 |
6 |
CXN |
C |
CXN |
N |
N |
N |
0 |
-5.121 |
7.584 |
0.209 |
7 |
C3A |
C |
C3A |
N |
Y |
N |
0 |
0.108 |
4.219 |
-0.012 |
8 |
C4A |
C |
C4A |
N |
Y |
N |
0 |
-0.564 |
2.986 |
0.011 |
9 |
C1A |
C |
C1A |
N |
Y |
N |
0 |
1.626 |
2.567 |
-0.034 |
10 |
CXD |
C |
CXD |
N |
Y |
N |
0 |
-2.734 |
4.956 |
1.192 |
11 |
NXT |
N |
NXT |
N |
Y |
N |
1 |
-4.307 |
6.367 |
0.167 |
12 |
NA |
N |
NA |
N |
Y |
N |
0 |
0.381 |
1.989 |
-0.004 |
13 |
NB |
N |
NB |
N |
Y |
N |
0 |
-2.065 |
0.394 |
0.018 |
14 |
NC |
N |
NC |
N |
Y |
N |
0 |
-0.381 |
-1.99 |
0.001 |
15 |
ND |
N |
ND |
N |
Y |
N |
0 |
2.066 |
-0.394 |
-0.021 |
16 |
CHB |
C |
CHB |
N |
Y |
N |
0 |
-1.961 |
2.859 |
0.047 |
17 |
C1B |
C |
C1B |
N |
Y |
N |
0 |
-2.613 |
1.608 |
0.04 |
18 |
CX4 |
C |
CX4 |
N |
Y |
N |
0 |
-5.564 |
-4.384 |
0.98 |
19 |
C2B |
C |
C2B |
N |
Y |
N |
0 |
-4.03 |
1.458 |
0.053 |
20 |
C72 |
C |
C72 |
N |
Y |
N |
0 |
-4.102 |
-2.777 |
-0.029 |
21 |
C82 |
C |
C82 |
N |
Y |
N |
0 |
-4.973 |
-2.751 |
-1.126 |
22 |
C92 |
C |
C92 |
N |
Y |
N |
0 |
-6.097 |
-3.549 |
-1.105 |
23 |
CXO |
C |
CXO |
N |
N |
N |
0 |
-7.563 |
-5.159 |
-0.096 |
24 |
C3B |
C |
C3B |
N |
Y |
N |
0 |
-4.284 |
0.13 |
0.036 |
25 |
C4B |
C |
C4B |
N |
Y |
N |
0 |
-3.023 |
-0.532 |
0.014 |
26 |
CXE |
C |
CXE |
N |
Y |
N |
0 |
-4.417 |
-3.62 |
1.045 |
27 |
NXU |
N |
NXU |
N |
Y |
N |
1 |
-6.357 |
-4.328 |
-0.072 |
28 |
CHC |
C |
CHC |
N |
Y |
N |
0 |
-2.879 |
-1.936 |
-0.005 |
29 |
C1C |
C |
C1C |
N |
Y |
N |
0 |
-1.627 |
-2.568 |
0.002 |
30 |
CX5 |
C |
CX5 |
N |
Y |
N |
0 |
3.55 |
-6.125 |
-0.985 |
31 |
C2C |
C |
C2C |
N |
Y |
N |
0 |
-1.456 |
-3.962 |
0.013 |
32 |
C73 |
C |
C73 |
N |
Y |
N |
0 |
2.787 |
-4.093 |
0.029 |
33 |
C83 |
C |
C83 |
N |
Y |
N |
0 |
3.609 |
-4.392 |
1.124 |
34 |
C93 |
C |
C93 |
N |
Y |
N |
0 |
4.359 |
-5.549 |
1.1 |
35 |
CXP |
C |
CXP |
N |
N |
N |
0 |
5.125 |
-7.585 |
0.086 |
36 |
C3C |
C |
C3C |
N |
Y |
N |
0 |
-0.108 |
-4.219 |
0.018 |
37 |
C4C |
C |
C4C |
N |
Y |
N |
0 |
0.564 |
-2.986 |
0.01 |
38 |
CXF |
C |
CXF |
N |
Y |
N |
0 |
2.767 |
-4.991 |
-1.046 |
39 |
NXV |
N |
NXV |
N |
Y |
N |
1 |
4.31 |
-6.367 |
0.066 |
40 |
CHD |
C |
CHD |
N |
Y |
N |
0 |
1.961 |
-2.86 |
0.009 |
41 |
C1D |
C |
C1D |
N |
Y |
N |
0 |
2.614 |
-1.609 |
-0.012 |
42 |
CX6 |
C |
CX6 |
N |
Y |
N |
0 |
5.528 |
4.358 |
-1.185 |
43 |
C2D |
C |
C2D |
N |
Y |
N |
0 |
4.03 |
-1.459 |
-0.028 |
44 |
C74 |
C |
C74 |
N |
Y |
N |
0 |
4.1 |
2.778 |
-0.089 |
45 |
C84 |
C |
C84 |
N |
Y |
N |
0 |
5.005 |
2.781 |
0.981 |
46 |
C94 |
C |
C94 |
N |
Y |
N |
0 |
6.127 |
3.579 |
0.904 |
47 |
CXQ |
C |
CXQ |
N |
N |
N |
0 |
7.56 |
5.161 |
-0.192 |
48 |
C3D |
C |
C3D |
N |
Y |
N |
0 |
4.284 |
-0.131 |
-0.047 |
49 |
C4D |
C |
C4D |
N |
Y |
N |
0 |
3.024 |
0.532 |
-0.042 |
50 |
CXG |
C |
CXG |
N |
Y |
N |
0 |
4.381 |
3.592 |
-1.194 |
51 |
CHA |
C |
CHA |
N |
Y |
N |
0 |
2.879 |
1.935 |
-0.053 |
52 |
NXW |
N |
NXW |
N |
Y |
N |
1 |
6.354 |
4.331 |
-0.156 |
53 |
H51 |
H |
H51 |
N |
N |
N |
0 |
-3.49 |
6.76 |
2.036 |
54 |
H11 |
H |
H11 |
N |
N |
N |
0 |
2.244 |
4.699 |
-0.067 |
55 |
H31 |
H |
H31 |
N |
N |
N |
0 |
-3.706 |
3.789 |
-1.841 |
56 |
H41 |
H |
H41 |
N |
N |
N |
0 |
-5.045 |
5.848 |
-1.703 |
57 |
H811 |
H |
H811 |
N |
N |
N |
0 |
-4.561 |
8.411 |
-0.227 |
58 |
H821 |
H |
H821 |
N |
N |
N |
0 |
-6.038 |
7.427 |
-0.358 |
59 |
H831 |
H |
H831 |
N |
N |
N |
0 |
-5.37 |
7.819 |
1.244 |
60 |
H21 |
H |
H21 |
N |
N |
N |
0 |
-0.353 |
5.195 |
-0.008 |
61 |
H61 |
H |
H61 |
N |
N |
N |
0 |
-2.091 |
4.736 |
2.031 |
62 |
H71 |
H |
H71 |
N |
N |
N |
0 |
0.199 |
1.036 |
0.004 |
63 |
H73 |
H |
H73 |
N |
N |
N |
0 |
-0.199 |
-1.037 |
-0.005 |
64 |
H52 |
H |
H52 |
N |
N |
N |
0 |
-5.813 |
-5.04 |
1.801 |
65 |
H12 |
H |
H12 |
N |
N |
N |
0 |
-4.761 |
2.252 |
0.073 |
66 |
H32 |
H |
H32 |
N |
N |
N |
0 |
-4.767 |
-2.115 |
-1.974 |
67 |
H42 |
H |
H42 |
N |
N |
N |
0 |
-6.775 |
-3.536 |
-1.946 |
68 |
H812 |
H |
H812 |
N |
N |
N |
0 |
-8.395 |
-4.604 |
0.339 |
69 |
H822 |
H |
H822 |
N |
N |
N |
0 |
-7.802 |
-5.423 |
-1.126 |
70 |
H832 |
H |
H832 |
N |
N |
N |
0 |
-7.391 |
-6.067 |
0.482 |
71 |
H22 |
H |
H22 |
N |
N |
N |
0 |
-5.257 |
-0.339 |
0.039 |
72 |
H62 |
H |
H62 |
N |
N |
N |
0 |
-3.773 |
-3.67 |
1.911 |
73 |
H53 |
H |
H53 |
N |
N |
N |
0 |
3.538 |
-6.825 |
-1.806 |
74 |
H13 |
H |
H13 |
N |
N |
N |
0 |
-2.245 |
-4.7 |
0.016 |
75 |
H33 |
H |
H33 |
N |
N |
N |
0 |
3.655 |
-3.726 |
1.973 |
76 |
H43 |
H |
H43 |
N |
N |
N |
0 |
4.996 |
-5.788 |
1.939 |
77 |
H813 |
H |
H813 |
N |
N |
N |
0 |
6.101 |
-7.375 |
-0.351 |
78 |
H823 |
H |
H823 |
N |
N |
N |
0 |
5.252 |
-7.92 |
1.115 |
79 |
H833 |
H |
H833 |
N |
N |
N |
0 |
4.628 |
-8.364 |
-0.491 |
80 |
H23 |
H |
H23 |
N |
N |
N |
0 |
0.354 |
-5.196 |
0.027 |
81 |
H63 |
H |
H63 |
N |
N |
N |
0 |
2.147 |
-4.799 |
-1.91 |
82 |
H54 |
H |
H54 |
N |
N |
N |
0 |
5.756 |
4.985 |
-2.034 |
83 |
H14 |
H |
H14 |
N |
N |
N |
0 |
4.761 |
-2.254 |
-0.026 |
84 |
H34 |
H |
H34 |
N |
N |
N |
0 |
4.826 |
2.168 |
1.852 |
85 |
H44 |
H |
H44 |
N |
N |
N |
0 |
6.831 |
3.588 |
1.724 |
86 |
H814 |
H |
H814 |
N |
N |
N |
0 |
7.34 |
6.14 |
0.236 |
87 |
H824 |
H |
H824 |
N |
N |
N |
0 |
8.349 |
4.681 |
0.387 |
88 |
H834 |
H |
H834 |
N |
N |
N |
0 |
7.887 |
5.282 |
-1.224 |
89 |
H24 |
H |
H24 |
N |
N |
N |
0 |
5.257 |
0.337 |
-0.064 |
90 |
H64 |
H |
H64 |
N |
N |
N |
0 |
3.71 |
3.62 |
-2.04 |
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