Core dictionary (coreCIF) version 2.3.1

Category GEOM_BOND

Name:
'_geom_bond_[]'

Definition:

   Data items in the GEOM_BOND category record details about
   bonds as calculated from the ATOM, CELL
   and SYMMETRY data.
Example:

Example 1 - based on data set TOZ of Willis, Beckwith & Tozer [Acta Cryst. (1991), C47, 2276-2277]. 
 
    loop_
    _geom_bond_atom_site_label_1
    _geom_bond_atom_site_label_2
    _geom_bond_distance
    _geom_bond_site_symmetry_1
    _geom_bond_site_symmetry_2
    _geom_bond_publ_flag
      O1  C2   1.342(4)  1_555  1_555  yes
      O1  C5   1.439(3)  1_555  1_555  yes
      C2  C3   1.512(4)  1_555  1_555  yes
      C2  O21  1.199(4)  1_555  1_555  yes
      C3  N4   1.465(3)  1_555  1_555  yes
      C3  C31  1.537(4)  1_555  1_555  yes
      C3  H3   1.00(3)   1_555  1_555  no
      N4  C5   1.472(3)  1_555  1_555  yes
    # - - - - data truncated for brevity - - - -


Type: null

Category: category_overview








































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