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2. In addition to the Table (Hydrogen-bond geometry), which will be
automatically numbered as Table 2,
you need to arrange the Table 1 (Selected geometric parameters)
with the Centroid...Centroid distances less than 3.700 A
(I see at least three such distances - 3.457(), 3.640, 3.672())  
and definitions of all centroids (Cg) in the Table' Legend.


{{{Use an example from another submission:
loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
_geom_contact_publ_flag
Cg1  Cg2  3.621(7) . 2_667  y
Cg3  Cg4  3.834(8) . 1_455 y

_publ_section_table_legends
;
Table 1. Selected geometric parameters (\%A)
Cg1, Cg2, Cg3 and Cg4 are centroids of C8-C11/C15/C16, N1/C5-C8/C16,
C19-C24 and N3/N4/C1-C3 respectively.
;
}}}
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