# # Copyright (C) 1999-2004 Liz Potterton, Peter Briggs # # This code is distributed under the terms and conditions of the # CCP4 Program Suite Licence Agreement as a CCP4 Library. # A copy of the CCP4 licence can be obtained by writing to the # CCP4 Secretary, Daresbury Laboratory, Warrington WA4 4AD, UK. # #CCP4i_cvs_Id $Id$ #CCP4I VERSION CCP4Interface 1.0.1 #CCP4I SCRIPT DEF Mol #CCP4I DATE 25/06/97 16:05:30 #CCP4I USER lizp dimension _positiveint 3 chem_comp_id _text "" chem_comp_name _text "" chem_comp_type _Mol_chem_comp_type "" nAtoms _positiveint 0 nH _positiveint 0 xy,0 _vector2 "" Coor,0 _vector3 "" Name,0 _Mol_atomname "" Element,0 _Mol_chem_comp_name C Type,0 _cif_atomtype "" Charge,0 _cif_partial_charge 0 nChiral _positiveint 0 ChiralCentre,0 _Mol_atomname "" ChiralNaybrs,0 _text "" Chirality,0 _Mol_chirality + nBonds _positiveint 0 Bonds,0 _list "" Bondtype,0 _positiveint "" nPlane _positiveint 0 plane,0 _list "" filename _text "" XY _list NULL