Run semi-empirical minimization
 &qmmm
    qm_theory='AM1', grms_tol=0.0005,
 scfconv=1.d-10, ndiis_attempts=700,   qmcharge=0,
 /
   8    O1       78.6220       72.9950      104.1710 
   6    C1       78.9390       72.1060      105.2030 
   1    H1       78.7900       73.9040      104.4640 
   6    C2       78.1500       72.4530      106.4730 
   8    O2       77.6510       71.2910      107.0680 
   1    H2       78.3890       70.7290      107.3500 
   6    C3       78.9640       73.2430      107.5080 
   8    O3       80.1860       73.6590      106.9780 
   1    H3       80.7260       72.8830      106.7600 
   6    C4       79.1740       72.5040      108.7940 
   7    N1       78.4920       72.8160      109.9270 
   6    C5       78.9810       71.9340      110.8100 
   6    C6       78.6330       71.7930      112.1510 
   6    C7       79.2870       70.7860      112.8860 
   6    C8       80.2550       69.9620      112.2690 
   6    C9       80.5800       70.1340      110.9110 
   6   C10       79.9130       71.1400      110.2160 
   7    N2       80.0600       71.4810      108.9290 
   1    H4       80.6590       71.0900      108.2520 
   6   C11       78.6790       70.6670      104.7560 
   8    O4       77.3170       70.4650      104.5140 
   1    H5       77.0240       71.0530      103.8000 
   6   C12       79.4930       70.3350      103.5430 
   7    N3       79.4030       71.0260      102.3740 
   6   C13       80.2890       70.3910      101.5940 
   6   C14       80.6160       70.6780      100.2710 
   6   C15       81.5850       69.8650       99.6540 
   6   C16       82.1900       68.8040      100.3650 
   6   C17       81.8330       68.5430      101.7010 
   6   C18       80.8710       69.3690      102.2790 
   7    N4       80.3830       69.3080      103.5250 
   1    H6       80.6110       68.6770      104.2460 
   1    H7       79.9800       72.1970      105.4350 
   1    H8       77.3480       73.0870      106.1550 
   1    H9       78.3750       74.1040      107.7450 
   1   H10       77.9240       72.4020      112.5880 
   1   H11       79.0580       70.6490      113.8830 
   1   H12       80.7280       69.2280      112.8190 
   1   H13       81.2850       69.5390      110.4480 
   1   H14       78.9770       70.0090      105.5460 
   1   H15       80.1660       71.4560       99.7630 
   1   H16       81.8560       70.0450       98.6750 
   1   H17       82.8990       68.2160       99.9010 
   1   H18       82.2660       67.7710      102.2310 

