
     RDKit          3D

 63 67  0  0  0  0  0  0  0  0999 V2000
    5.7874   -2.3025    2.3387 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6257   -1.4205    2.5540 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9408   -1.8138    3.7981 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0446   -0.0061    2.6470 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3246    0.5975    1.2648 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1854    0.3963    0.3725 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1211    1.2113    0.2448 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2692    0.6656   -0.7016 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9908    1.2307   -1.2099 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5098    2.4667   -0.7368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6712    3.0107   -1.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4237    2.3166   -2.1973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9525    1.0770   -2.6872 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2556    0.5522   -2.1977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6604    0.3361   -3.7500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0365    0.9469   -4.7842 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8901   -1.0786   -3.6445 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9000   -1.7766   -2.3887 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4932   -3.1169   -2.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4363   -3.7591   -1.0937 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8164   -3.0742    0.0629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2883   -1.7567   -0.0333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2990   -1.1449   -1.2486 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7180   -1.0279    1.1833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2331   -1.3089    2.4096 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8218   -0.4851    3.2646 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6632    0.2870    2.5545 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6241   -0.0212    1.2441 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4397    0.6004    0.1969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0213    2.0656    0.0048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6161    2.7026   -1.2641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9024    2.2967   -2.5615 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6076    2.9027   -2.6601 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8976   -0.5111   -1.0954 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0608   -0.6486   -0.4283 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4632   -3.3650    2.2859 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2747   -2.0784    1.3702 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5351   -2.1967    3.1577 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9849   -1.2614    3.8933 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6916   -2.8961    3.7905 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5741   -1.6109    4.6886 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2339    0.6033    3.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9473    0.1077    3.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5229    1.6845    1.3799 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2378    0.1483    0.8188 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9978    2.1409    0.7874 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0502    3.0286    0.0132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0228    3.9661   -0.8735 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6185   -0.3820   -2.6088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9984   -1.6239   -4.5294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1825   -3.6398   -3.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0947   -4.7863   -1.0354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7703   -3.5769    1.0178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2929    1.0574    2.9855 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3669    0.0340   -0.7504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5103    0.5658    0.5004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3898    2.6432    0.8814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9181    2.1469    0.0082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5715    3.8097   -1.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6900    2.4300   -1.3309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8623    1.1899   -2.6608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5087    2.6751   -3.4131 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5486   -1.2235   -1.8303 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
  8 34  1  0
 34 35  2  0
 35  6  1  0
 14  9  1  0
 23 18  1  0
 28 24  1  0
 33 12  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  3 39  1  0
  3 40  1  0
  3 41  1  0
  4 42  1  0
  4 43  1  0
  5 44  1  0
  5 45  1  0
  7 46  1  0
 10 47  1  0
 11 48  1  0
 14 49  1  0
 17 50  1  0
 19 51  1  0
 20 52  1  0
 21 53  1  0
 27 54  1  0
 29 55  1  0
 29 56  1  0
 30 57  1  0
 30 58  1  0
 31 59  1  0
 31 60  1  0
 32 61  1  0
 32 62  1  0
 34 63  1  0
M  END
$$$$
