Run semi-empirical minimization
 &qmmm
    qm_theory='AM1', grms_tol=0.0002,
  tight_p_conv=1, scfconv=1.d-10,   qmcharge=0,
 /
   6    C1       -1.8780       -1.1050        0.8590 
   6    C2       -1.8750        0.1980        1.3850 
   6    C3       -1.8820        1.3050        0.5290 
   6    C4       -1.8800        1.1090       -0.8620 
   6    C5       -1.8850       -0.1860       -1.3920 
   6    C6       -1.8770       -1.2930       -0.5270 
   6    C7       -1.7560       -2.2580        1.8070 
   6    C8       -1.7660        2.7030        1.0540 
   6    C9       -1.7730       -0.4300       -2.8660 
   1    H1       -1.8180       -2.2900       -0.9490 
   1    H2       -1.8160        0.3310        2.4590 
   1    H3       -1.8260        1.9720       -1.5150 
   8    O1       -1.0150       -2.1780        2.8260 
   8    O2       -1.0310        3.5490        0.4730 
   8    O3       -1.0310       -1.3490       -3.3120 
   7    N1       -2.4680       -3.3750        1.5230 
   7    N2       -2.4790        3.0130        2.1630 
   7    N3       -2.4950        0.3700       -3.6860 
   1    H4       -3.1740       -3.4340        0.7910 
   1    H5       -2.3260       -4.1780        2.1190 
   1    H6       -3.1830        2.4050        2.5790 
   1    H7       -2.3420        3.9310        2.5610 
   1    H8       -3.2020        1.0300       -3.3650 
   1    H9       -2.3610       -0.2560       -4.6810 
   6   C10       -5.5790       -1.3120       -0.5080 
   6   C11       -5.5740       -1.0970        0.8800 
   6   C12       -5.5760        0.2030        1.3940 
   6   C13       -5.5820        1.2980        0.5140 
   6   C14       -5.5880        1.0930       -0.8690 
   6   C15       -5.5840       -0.2160       -1.3770 
   6   C16       -5.4100       -2.7150       -1.0000 
   6   C17       -5.4060        0.4800        2.8540 
   6   C18       -5.4280        2.2210       -1.8390 
   1   H10       -5.5040       -0.3510       -2.4500 
   1   H11       -5.4850       -1.9580        1.5330 
   1   H12       -5.4980        2.2950        0.9340 
   8    O4       -4.7440       -3.5530       -0.3380 
   8    O5       -4.7470        1.4790        3.2470 
   8    O6       -4.7670        2.0680       -2.9000 
   7    N4       -5.9870       -3.0400       -2.1850 
   7    N5       -5.9720       -0.3890        3.7300 
   7    N6       -6.0040        3.4090       -1.5240 
   1   H13       -6.5970       -2.4140       -2.6860 
   1   H14       -5.8330       -3.9660       -2.5570 
   1   H15       -6.5760       -1.1410        3.4410 
   1   H16       -5.8170       -0.2460        4.7180 
   1   H17       -6.6080        3.5280       -0.7260 
   1   H18       -5.8560        4.1940       -2.1410 
   6   C19        5.5230       -1.1270        0.8400 
   6   C20        5.5380        0.1660        1.3830 
   6   C21        5.5290        1.2890        0.5440 
   6   C22        5.5350        1.1110       -0.8490 
   6   C23        5.5190       -0.1760       -1.4000 
   6   C24        5.5300       -1.2930       -0.5500 
   6   C25        5.5100       -2.2880        1.7880 
   6   C26        5.5210        2.6900        1.0760 
   6   C27        5.5020       -0.4160       -2.8790 
   1   H19        5.5490       -2.2810       -0.9960 
   1   H20        5.5640        0.2750        2.4620 
   1   H21        5.5590        1.9920       -1.4810 
   8    O7        6.0670       -2.2200        2.9130 
   8    O8        6.0780        3.6290        0.4530 
   8    O9        6.0530       -1.4260       -3.3840 
   7    N7        4.8370       -3.4010        1.3740 
   7    N8        4.8540        2.8890        2.2510 
   7    N9        4.8330        0.5040       -3.6340 
   1   H22        4.1970       -3.4190        0.5810 
   1   H23        4.8480       -4.1960        1.9960 
   1   H24        4.2150        2.2130        2.6650 
   1   H25        4.8700        3.8250        2.6290 
   1   H26        4.1980        1.2020       -3.2510 
   1   H27        4.8410        0.3640       -4.6330 
   6   C28        1.8250       -1.2790       -0.5680 
   6   C29        1.8360       -1.1250        0.8270 
   6   C30        1.8330        0.1530        1.3970 
   6   C31        1.8360        1.2850        0.5660 
   6   C32        1.8260        1.1390       -0.8260 
   6   C33        1.8270       -0.1470       -1.3900 
   6   C34        1.9220       -2.6600       -1.1380 
   6   C35        1.9380        0.3500        2.8770 
   6   C36        1.9270        2.3230       -1.7370 
   1   H28        1.8730       -0.2480       -2.4690 
   1   H29        1.8900       -2.0080        1.4540 
   1   H30        1.8910        2.2690        1.0170 
   8   O10        2.6490       -3.5380       -0.5940 
   8   O11        2.6690        1.2590        3.3620 
   8   O12        2.6570        2.2890       -2.7670 
   7   N10        1.1920       -2.9200       -2.2500 
   7   N11        1.2130       -0.4830        3.6630 
   7   N12        1.2030        3.4200       -1.4070 
   1   H31        0.4890       -2.2880       -2.6330 
   1   H32        1.3120       -3.8260       -2.6800 
   1   H33        0.5080       -1.1310        3.3120 
   1   H34        1.3410       -0.4030        4.6610 
   1   H35        0.4980        3.4390       -0.6700 
   1   H36        1.3290        4.2440       -1.9760 
   6   C37       12.6320       -1.1050        0.8590 
   6   C38       12.6350        0.1980        1.3850 
   6   C39       12.6280        1.3050        0.5290 
   6   C40       12.6300        1.1090       -0.8620 
   6   C41       12.6250       -0.1860       -1.3920 
   6   C42       12.6330       -1.2930       -0.5270 
   6   C43       12.7540       -2.2580        1.8070 
   6   C44       12.7440        2.7030        1.0540 
   6   C45       12.7370       -0.4300       -2.8660 
   1   H37       12.6920       -2.2900       -0.9490 
   1   H38       12.6940        0.3310        2.4590 
   1   H39       12.6840        1.9720       -1.5150 
   8   O13       13.4950       -2.1780        2.8260 
   8   O14       13.4790        3.5490        0.4730 
   8   O15       13.4790       -1.3490       -3.3120 
   7   N13       12.0420       -3.3750        1.5230 
   7   N14       12.0310        3.0130        2.1630 
   7   N15       12.0150        0.3700       -3.6860 
   1   H40       11.3360       -3.4340        0.7910 
   1   H41       12.1840       -4.1780        2.1190 
   1   H42       11.3270        2.4050        2.5790 
   1   H43       12.1680        3.9310        2.5610 
   1   H44       11.3080        1.0300       -3.3650 
   1   H45       12.1490       -0.2560       -4.6810 
   6   C46        8.9310       -1.3120       -0.5080 
   6   C47        8.9360       -1.0970        0.8800 
   6   C48        8.9340        0.2030        1.3940 
   6   C49        8.9280        1.2980        0.5140 
   6   C50        8.9220        1.0930       -0.8690 
   6   C51        8.9260       -0.2160       -1.3770 
   6   C52        9.1000       -2.7150       -1.0000 
   6   C53        9.1040        0.4800        2.8540 
   6   C54        9.0820        2.2210       -1.8390 
   1   H46        9.0060       -0.3510       -2.4500 
   1   H47        9.0250       -1.9580        1.5330 
   1   H48        9.0120        2.2950        0.9340 
   8   O16        9.7660       -3.5530       -0.3380 
   8   O17        9.7630        1.4790        3.2470 
   8   O18        9.7430        2.0680       -2.9000 
   7   N16        8.5230       -3.0400       -2.1850 
   7   N17        8.5380       -0.3890        3.7300 
   7   N18        8.5060        3.4090       -1.5240 
   1   H49        7.9130       -2.4140       -2.6860 
   1   H50        8.6770       -3.9660       -2.5570 
   1   H51        7.9340       -1.1410        3.4410 
   1   H52        8.6930       -0.2460        4.7180 
   1   H53        7.9020        3.5280       -0.7260 
   1   H54        8.6540        4.1940       -2.1410 
   6   C55       20.0330       -1.1270        0.8400 
   6   C56       20.0480        0.1660        1.3830 
   6   C57       20.0390        1.2890        0.5440 
   6   C58       20.0450        1.1110       -0.8490 
   6   C59       20.0290       -0.1760       -1.4000 
   6   C60       20.0400       -1.2930       -0.5500 
   6   C61       20.0200       -2.2880        1.7880 
   6   C62       20.0310        2.6900        1.0760 
   6   C63       20.0120       -0.4160       -2.8790 
   1   H55       20.0590       -2.2810       -0.9960 
   1   H56       20.0740        0.2750        2.4620 
   1   H57       20.0690        1.9920       -1.4810 
   8   O19       20.5770       -2.2200        2.9130 
   8   O20       20.5880        3.6290        0.4530 
   8   O21       20.5630       -1.4260       -3.3840 
   7   N19       19.3470       -3.4010        1.3740 
   7   N20       19.3650        2.8890        2.2510 
   7   N21       19.3430        0.5040       -3.6340 
   1   H58       18.7070       -3.4190        0.5810 
   1   H59       19.3580       -4.1960        1.9960 
   1   H60       18.7250        2.2130        2.6650 
   1   H61       19.3800        3.8250        2.6290 
   1   H62       18.7080        1.2020       -3.2510 
   1   H63       19.3510        0.3640       -4.6330 
   6   C64       16.3350       -1.2790       -0.5680 
   6   C65       16.3460       -1.1250        0.8270 
   6   C66       16.3430        0.1530        1.3970 
   6   C67       16.3460        1.2850        0.5660 
   6   C68       16.3360        1.1390       -0.8260 
   6   C69       16.3370       -0.1470       -1.3900 
   6   C70       16.4320       -2.6600       -1.1380 
   6   C71       16.4480        0.3500        2.8770 
   6   C72       16.4370        2.3230       -1.7370 
   1   H64       16.3830       -0.2480       -2.4690 
   1   H65       16.4000       -2.0080        1.4540 
   1   H66       16.4010        2.2690        1.0170 
   8   O22       17.1590       -3.5380       -0.5940 
   8   O23       17.1790        1.2590        3.3620 
   8   O24       17.1670        2.2890       -2.7670 
   7   N22       15.7020       -2.9200       -2.2500 
   7   N23       15.7230       -0.4830        3.6630 
   7   N24       15.7130        3.4200       -1.4070 
   1   H67       14.9990       -2.2880       -2.6330 
   1   H68       15.8220       -3.8260       -2.6800 
   1   H69       15.0180       -1.1310        3.3120 
   1   H70       15.8510       -0.4030        4.6610 
   1   H71       15.0080        3.4390       -0.6700 
   1   H72       15.8390        4.2440       -1.9760 

