
     RDKit          3D

 68 71  0  0  0  0  0  0  0  0999 V2000
    1.8707    4.8003    0.2127 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0296    3.7837    0.9797 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4828    2.4078    0.7247 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3177    1.7216    1.7337 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6717    1.2686    1.1581 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9595   -0.0441    1.6324 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7357   -0.9464    0.9015 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0207   -0.5828    0.4598 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8089   -1.4998   -0.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3270   -2.7857   -0.5061 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0482   -3.1544   -0.0684 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2346   -2.2325    0.6188 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8106   -2.6080    0.9626 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9227   -2.6790   -0.2980 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5803   -1.3062   -0.9145 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4366   -0.6049   -0.1501 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0383    0.7885   -0.7329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2138    1.3409   -0.0097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4068    0.5739   -0.3746 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5385    0.5990    0.5216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6512    1.5465    1.3439 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6320   -0.4438    0.4467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0494   -0.9223    1.8483 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2904   -1.8266    1.7511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3580   -1.1371    1.1197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0241   -0.8673   -0.2273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8509    0.1179   -0.3075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6182    0.3314   -1.8056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3214   -0.1088   -2.4779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2193    0.7179   -2.1348 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1872    1.7798   -0.5434 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8639    2.1223   -1.5556 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4544    5.8153    0.3850 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9291    4.7560    0.5523 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8201    4.6081   -0.8800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0394    3.9011    0.7046 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0953    4.0158    2.0696 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7603    0.8730    2.1779 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5287    2.3903    2.5972 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4861    1.9631    1.4820 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6661    1.2699    0.0471 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4190    0.4035    0.6777 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7978   -1.2196   -0.5947 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9419   -3.4958   -1.0454 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6851   -4.1546   -0.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8121   -3.6076    1.4521 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3803   -1.9057    1.7081 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4137   -3.3195   -1.0668 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9745   -3.2032   -0.0240 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4773   -0.6595   -0.9664 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2490   -1.4938   -1.9639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4456   -1.2812   -0.1476 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7055   -0.5130    0.9141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3897    2.3976   -0.3124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0560    1.3063    1.0920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2563   -1.3354   -0.1029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2839   -0.0531    2.4990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2214   -1.4935    2.3231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6093   -2.1027    2.7739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0555   -2.7812    1.2251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8026   -1.8036   -0.7883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9036   -0.3994   -0.7218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5980    0.3011   -1.3710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1729    1.0838    0.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3669   -0.4643   -1.9772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9841    1.2668   -2.2783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1130   -1.1774   -2.2778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4707   -0.0381   -3.5730 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  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  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 19 28  1  0
 28 29  1  0
 29 30  1  0
 17 31  1  0
 31 32  2  0
 31  3  1  0
 12  7  1  0
 30 17  1  0
 27 22  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  2 36  1  0
  2 37  1  0
  4 38  1  0
  4 39  1  0
  5 40  1  0
  5 41  1  0
  8 42  1  0
  9 43  1  0
 10 44  1  0
 11 45  1  0
 13 46  1  0
 13 47  1  0
 14 48  1  0
 14 49  1  0
 15 50  1  0
 15 51  1  0
 16 52  1  0
 16 53  1  0
 18 54  1  0
 18 55  1  0
 22 56  1  0
 23 57  1  0
 23 58  1  0
 24 59  1  0
 24 60  1  0
 26 61  1  0
 26 62  1  0
 27 63  1  0
 27 64  1  0
 28 65  1  0
 28 66  1  0
 29 67  1  0
 29 68  1  0
M  END
$$$$
