T O N T O
A free object-based system for computational chemistry
Version: 3.2 rev. 4048
Platform: GNU-gfortran-on-WINDOWS
Build-date: Tue, Jun 11, 2013 8:18:30 AM
For conditions of use, on-line documentation, and contributor
and developer information see :-
www.theochem.uwa.edu.au/tonto/
Dylan Jayatilaka
Daniel Grimwood
_______________________________________________________________
Timer started at 28/02/2023 14:04:33.
Warning from MOLECULE.CE:find_CIF_crystal_data_block ... Job name has now been set to: sy23-publ_shelx
Error in SPACEGROUP:decode_Jones_Faithful_symbol ... unknown item, +1
File name = C:/Users/fizik/Desktop/emine berrin/SY23/sy23-publ.cif
Line number = 115
File buffer = _cell_length_a 14.5724(12)
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