5#ifndef BALL_FORMAT_MOPACOUTPUTFILE_H
6#define BALL_FORMAT_MOPACOUTPUTFILE_H
8#ifndef BALL_COMMON_GLOBAL_H
12#ifndef BALL_FORMAT_GENERICMOLFILE_H
16#ifndef BALL_KERNEL_ATOMCONTAINER_H
20#ifndef BALL_DATATYPE_STRING_H
std::vector< Atom * > atoms_
virtual bool read(System &system)
MOPACOutputFile(const String &filename, File::OpenMode open_mode=std::ios::in)
std::map< String, Size > type_counts_
void addAtom_(const String &line, Molecule *mol)
virtual ~MOPACOutputFile()
virtual Molecule * read()
std::ios::openmode OpenMode