void write_orca_input(t_forcerec *fr, t_QMrec *qm, t_MMrec *mm)
{
- int i;
+ int i;
t_QMMMrec *QMMMrec;
- FILE *out, *pcFile, *addInputFile, *LJCoeff;
- char *buf, *orcaInput, *addInputFilename, *LJCoeffFilename, *pcFilename, *exclInName, *exclOutName;
+ FILE *out, *pcFile, *addInputFile, *LJCoeff;
+ char *buf, *orcaInput, *addInputFilename, *LJCoeffFilename, *pcFilename, *exclInName, *exclOutName;
QMMMrec = fr->qr;