2906     int         k, c_point, cg, centerpoint, fictpoint, type, ret = 0;  in CreateCGroupInBnStruct()  local
2920     for ( c_point = 0, num_CPoints = 0; c_point < num_atoms; c_point ++ ) {  in CreateCGroupInBnStruct()
2921         if ( (nType & GetAtomChargeType( at, c_point, NULL, &mask, 0 )) && (mask & nMask)  in CreateCGroupInBnStruct()
2923              && ( at[c_point].charge == nCharge || !at[c_point].charge )  in CreateCGroupInBnStruct()
2966     for ( c_point = 0; c_point < num_atoms; c_point ++ ) {  in CreateCGroupInBnStruct()
2967         if ( (nType & (type=GetAtomChargeType( at, c_point, NULL, &mask, 0 ))) && (mask & nMask)  in CreateCGroupInBnStruct()
2969              && ( at[c_point].charge == nCharge || !at[c_point].charge)  in CreateCGroupInBnStruct()
2976         vertex_cpoint = pBNS->vert + c_point;   /* c_point vertex */  in CreateCGroupInBnStruct()
2997                 centerpoint = (pBNS->edge[iedge].neighbor12 ^ c_point);  in CreateCGroupInBnStruct()
3000                     int bond_type = (at[c_point].bond_type[k] & BOND_TYPE_MASK);  in CreateCGroupInBnStruct()
3020 …    if ( (nCharge==1 && (at[c_point].charge != 1)) || (nCharge==-1 && (at[c_point].charge == -1)) )  in CreateCGroupInBnStruct()
3039             centerpoint = (pBNS->edge[iedge].neighbor12 ^ c_point);  in CreateCGroupInBnStruct()
3059         edge->neighbor1    = c_point; /* the smallest out of v1=endopoint and v2=num_vertices */  in CreateCGroupInBnStruct()
3060         edge->neighbor12   = c_point ^ fictpoint; /* v1 ^ v2 */  in CreateCGroupInBnStruct()
3288             at->c_point = 0;  in RemoveLastGroupFromBnStruct()
7319                         at[endpoint].c_point  = 0;  in ReInitBnStruct()
7556         int         i, k, c_point, centerpoint, fictpoint;  in AddCGroups2BnStruct()  local
7619         for ( c_point = 0; c_point < num_atoms; c_point ++ ) {  in AddCGroups2BnStruct()
7620             if ( !at[c_point].c_point )  in AddCGroups2BnStruct()
7622             fictpoint = at[c_point].c_point + num_vertices - 1; /* c-group vertex index */  in AddCGroups2BnStruct()
7624             vertex_cpoint = pBNS->vert + c_point;   /* c_point vertex */  in AddCGroups2BnStruct()
7642                     centerpoint = (pBNS->edge[iedge].neighbor12 ^ c_point);  in AddCGroups2BnStruct()
7645                         int bond_type = (at[c_point].bond_type[k] & BOND_TYPE_MASK);  in AddCGroups2BnStruct()
7664             if ( !CHARGED_CPOINT(at,c_point) ) {  in AddCGroups2BnStruct()
7681                 centerpoint = (pBNS->edge[iedge].neighbor12 ^ c_point);  in AddCGroups2BnStruct()
7701             edge->neighbor1    = c_point; /* the smallest out of v1=endopoint and v2=num_vertices */  in AddCGroups2BnStruct()
7702             edge->neighbor12   = c_point ^ fictpoint; /* v1 ^ v2 */  in AddCGroups2BnStruct()