Molecular Information File dictionary (MIF) version 1.2.3
_atom_type
Name:'_atom_type'
Definition:
Specifies the type of atom site identified by _atom_id. Hydrogen atoms will usually not be assigned to sites except where they are connected to more than one other atom, or where it is necessary to reference them, for example, in describing stereochemistry.
Appears in list containing _atom_id
The data value must be one of the following:
|
H | 1 |
|
He | 2 |
|
Li | 3 |
|
Be | 4 |
|
B | 5 |
|
C | 6 |
|
N | 7 |
|
O | 8 |
|
F | 9 |
|
Ne | 10 |
|
Na | 11 |
|
Mg | 12 |
|
Al | 13 |
|
Si | 14 |
|
P | 15 |
|
S | 16 |
|
Cl | 17 |
|
Ar | 18 |
|
K | 19 |
|
Ca | 20 |
|
Sc | 21 |
|
Ti | 22 |
|
V | 23 |
|
Cr | 24 |
|
Mn | 25 |
|
Fe | 26 |
|
Co | 27 |
|
Ni | 28 |
|
Cu | 29 |
|
Zn | 30 |
|
Ga | 31 |
|
Ge | 32 |
|
As | 33 |
|
Se | 34 |
|
Br | 35 |
|
Kr | 36 |
|
Rb | 37 |
|
Sr | 38 |
|
Y | 39 |
|
Zr | 40 |
|
Nb | 41 |
|
Mo | 42 |
|
Tc | 43 |
|
Ru | 44 |
|
Rh | 45 |
|
Pd | 46 |
|
Ag | 47 |
|
Cd | 48 |
|
In | 49 |
|
Sn | 50 |
|
Sb | 51 |
|
Te | 52 |
|
I | 53 |
|
Xe | 54 |
|
Cs | 55 |
|
Ba | 56 |
|
La | 57 |
|
Ce | 58 |
|
Pr | 59 |
|
Nd | 60 |
|
Pm | 61 |
|
Sm | 62 |
|
Eu | 63 |
|
Gd | 64 |
|
Tb | 65 |
|
Dy | 66 |
|
Ho | 67 |
|
Er | 68 |
|
Tm | 69 |
|
Yb | 70 |
|
Lu | 71 |
|
Hf | 72 |
|
Ta | 73 |
|
W | 74 |
|
Re | 75 |
|
Os | 76 |
|
Ir | 77 |
|
Pt | 78 |
|
Au | 79 |
|
Hg | 80 |
|
Tl | 81 |
|
Pb | 82 |
|
Bi | 83 |
|
Po | 84 |
|
At | 85 |
|
Rn | 86 |
|
Fr | 87 |
|
Ra | 88 |
|
Ac | 89 |
|
Th | 90 |
|
Pa | 91 |
|
U | 92 |
|
Np | 93 |
|
Pu | 94 |
|
Am | 95 |
|
Cm | 96 |
|
Bk | 97 |
|
Cf | 98 |
|
Es | 99 |
|
Fm | 100 |
|
Md | 101 |
|
No | 102 |
|
Lr | 103 |
|
usp | un-shared electron pair |
|
dum | dummy atom |
Type: char
Category: atom
