   41 ATOMS,    43 BONDS,     0 CHARGES, ATROPINE            
    1 N3     -2.4263   2.1590   1.4846     0.0000
    2 C3     -1.9467   1.0768   2.3576     0.0000
    3 C3     -0.5243   1.4640   2.8219     0.0000
    4 C3      0.4312   1.6509   1.6189     0.0000
    5 C3     -0.2366   2.4642   0.4841     0.0000
    6 C3     -1.6843   1.9890   0.2260     0.0000
    7 C3     -1.8382  -0.1380   1.4179     0.0000
    8 C3     -1.6651   0.4648   0.0092     0.0000
    9 H      -2.4892   0.1333  -0.6224     0.0000
   10 H      -0.7172   0.1252  -0.4081     0.0000
   11 H      -0.9698  -0.7549   1.6491     0.0000
   12 H      -2.7418  -0.7472   1.4346     0.0000
   13 H      -2.0850   2.4694  -0.6665     0.0000
   14 H      -0.2539   3.5158   0.7704     0.0000
   15 H       0.3466   2.3369  -0.4278     0.0000
   16 H       1.3210   2.1807   1.9590     0.0000
   17 O3      0.7922   0.3654   1.1184     0.0000
   18 H      -0.5802   2.3989   3.3794     0.0000
   19 H      -0.1373   0.6718   3.4628     0.0000
   20 H      -2.5628   0.8079   3.2156     0.0000
   21 H      -3.4252   2.0794   1.2946     0.0000
   22 C2      1.6461   0.5176   0.1049     0.0000
   23 O2      1.9896   1.6454  -0.2458     0.0000
   24 C3      2.1912  -0.6945  -0.6119     0.0000
   25 CAR     1.0446  -1.5826  -1.0140     0.0000
   26 H       2.8052  -1.1882   0.0039     0.0000
   27 C3      2.9622  -0.2326  -1.8636     0.0000
   28 H       2.3873   0.3968  -2.3863     0.0000
   29 H       3.1870  -1.0319  -2.4209     0.0000
   30 O3      4.1585   0.4271  -1.4548     0.0000
   31 H       4.1435   1.3679  -1.7934     0.0000
   32 CAR     0.6620  -2.6417  -0.1923     0.0000
   33 CAR    -0.3999  -3.4644  -0.5647     0.0000
   34 CAR    -1.0792  -3.2280  -1.7587     0.0000
   35 CAR    -0.6967  -2.1691  -2.5805     0.0000
   36 CAR     0.3653  -1.3463  -2.2082     0.0000
   37 H       1.1904  -2.8254   0.7364     0.0000
   38 H      -0.6973  -4.2879   0.0745     0.0000
   39 H      -1.9049  -3.8677  -2.0482     0.0000
   40 H      -1.2247  -1.9851  -3.5089     0.0000
   41 H       0.6630  -0.5227  -2.8470     0.0000
    1     1     2  SINGLE  
    2     1     6  SINGLE  
    3     2     3  SINGLE  
    4     3     4  SINGLE  
    5     4     5  SINGLE  
    6     5     6  SINGLE  
    7     2     7  SINGLE  
    8     6     8  SINGLE  
    9     8     7  SINGLE  
   10     8     9  SINGLE  
   11     8    10  SINGLE  
   12     7    11  SINGLE  
   13     7    12  SINGLE  
   14     6    13  SINGLE  
   15     5    14  SINGLE  
   16     5    15  SINGLE  
   17     4    16  SINGLE  
   18     4    17  SINGLE  
   19     3    18  SINGLE  
   20     3    19  SINGLE  
   21     2    20  SINGLE  
   22     1    21  SINGLE  
   23    17    22  SINGLE  
   24    22    23  DOUBLE  
   25    22    24  SINGLE  
   26    24    25  SINGLE  
   27    24    26  SINGLE  
   28    24    27  SINGLE  
   29    27    28  SINGLE  
   30    27    29  SINGLE  
   31    27    30  SINGLE  
   32    30    31  SINGLE  
   33    25    32  AROMATIC
   34    32    33  AROMATIC
   35    33    34  AROMATIC
   36    34    35  AROMATIC
   37    35    36  AROMATIC
   38    36    25  AROMATIC
   39    32    37  SINGLE  
   40    33    38  SINGLE  
   41    34    39  SINGLE  
   42    35    40  SINGLE  
   43    36    41  SINGLE  
