#include <iostream>
#include <iomanip>
#include <fstream>
#include <cstdio>
#include <vector>
#include <cstring>
#include <math.h>
#include "stringtools.h"
#include "qchem.h"
#include "gaussian.h"
#include "ase.h"
#include "knnr.h"
#include "orca.h"
#include "molpro.h"
#include "qchemsf.h"
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class | Gradient |