
     RDKit          3D

 52 56  0  0  0  0  0  0  0  0999 V2000
    8.5624    0.0216    1.1900 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1145    0.0461    1.3435 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2166   -0.2109    0.3757 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9505   -0.0081    0.8972 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6467   -0.1690    0.2038 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5751   -0.8118   -1.0462 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3479   -0.9732   -1.6938 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1723   -0.5006   -1.1065 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2319    0.1830    0.1222 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4618    0.3277    0.7796 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0225    0.7927    0.6954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4266    0.3772    1.7973 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6118    1.8832    0.0162 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0123    2.1688    0.1271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5002    3.4288   -0.2361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8739    3.6659   -0.2020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7487    2.6405    0.1598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2353    1.3759    0.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8877    1.1888    0.4847 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1557    0.2570    0.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4699    0.4456    1.0484 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0099   -0.7451    1.2568 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0232   -1.6513    1.1406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8441   -1.0617    0.8669 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5865   -1.7704    0.6080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4539   -2.1673   -0.8815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3944   -1.3606   -1.6517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9646   -1.7110   -1.2259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0525   -0.7407   -1.7359 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1718    0.3892    2.2092 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4966    0.4212    2.4514 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0480   -0.1023    2.1810 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8624   -0.8262    0.5380 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9035    0.9742    0.7336 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4725   -0.5032   -0.6342 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4617   -1.2108   -1.5195 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3065   -1.4921   -2.6431 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4903    0.8589    1.7220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0305    2.4681   -0.6262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8232    4.2164   -0.5421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2624    4.6388   -0.4739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8149    2.8294    0.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1670   -2.7193    1.2424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7291   -1.1823    0.9806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5761   -2.7012    1.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4331   -2.0428   -1.3938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1980   -3.2475   -0.9528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4981   -1.5813   -2.7363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5801   -0.2766   -1.5289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6897   -2.7122   -1.6217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8850   -1.7575   -0.1206 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4232    0.6380    2.9483 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
  4 30  1  0
 30 31  2  0
 31  2  1  0
 10  5  1  0
 19 14  1  0
 24 20  1  0
 29  8  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  3 35  1  0
  6 36  1  0
  7 37  1  0
 10 38  1  0
 13 39  1  0
 15 40  1  0
 16 41  1  0
 17 42  1  0
 23 43  1  0
 25 44  1  0
 25 45  1  0
 26 46  1  0
 26 47  1  0
 27 48  1  0
 27 49  1  0
 28 50  1  0
 28 51  1  0
 30 52  1  0
M  END
$$$$
