
     RDKit          3D

 83 88  0  0  0  0  0  0  0  0999 V2000
   -3.0164    2.5440   -3.7668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9309    1.8596   -2.7105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2113    0.3745   -2.7808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5922    0.0207   -3.3577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7302    0.0637   -2.3298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5723   -0.9562   -1.3337 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5204   -1.2502   -0.3309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8263   -0.7163   -0.3805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7594   -1.0224    0.6113 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4089   -1.8577    1.6697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1219   -2.3868    1.7466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1666   -2.0938    0.7576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7514   -2.5962    0.9573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9344   -1.6734    1.8901 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9059   -0.2432    1.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7624    0.6551    1.8737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9536    1.3876    0.7438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1130    0.3144   -0.0408 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2585    0.0517    0.5860 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0521    1.2907    0.6173 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4969    1.2553    0.5713 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1502    2.3329    0.6162 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2464   -0.0495    0.4790 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6598    0.1472    0.5168 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4473    0.5777   -0.5662 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8809    1.0081   -1.7836 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7028    1.3943   -2.8458 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0911    1.3531   -2.7096 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6627    0.9281   -1.5090 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8477    0.5456   -0.4325 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4446    0.0893    0.7901 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2354    0.5663    2.0302 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9651   -0.1102    2.9387 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6455   -1.0386    2.2818 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3189   -0.9177    0.9801 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8697   -1.8058   -0.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8299   -2.5508   -0.9259 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6265   -3.2911    0.1342 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3515    2.5826    0.7091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9898    2.4167    1.4357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9659    2.1746   -0.1846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4386    2.4901   -1.5123 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4352   -0.0722   -3.4394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0941   -0.1095   -1.8019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5460   -1.0087   -3.7737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8382    0.6998   -4.2019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7767    1.0630   -1.8464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6765   -0.1060   -2.8885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1367   -0.0603   -1.1810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7563   -0.6051    0.5599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1338   -2.0838    2.4414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8593   -3.0105    2.5921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7761   -3.6172    1.3949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2324   -2.6934   -0.0203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9008   -2.0753    1.9476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3663   -1.6781    2.9139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8121   -0.3487    0.2577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8824    0.2502    1.5474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2106    1.4163    2.5507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0655    0.0581    2.5023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6370   -0.6608   -0.1087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9118    0.6436   -1.0797 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1493   -0.3467    1.6174 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7539   -0.7230   -0.0349 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9627   -0.6800    1.3478 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9706   -0.5977   -0.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8086    1.0451   -1.9195 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2623    1.7206   -3.7784 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7247    1.6527   -3.5340 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7408    0.9009   -1.4123 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5800    1.3925    2.2708 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8230   -1.5510   -0.6102 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1488   -2.7680   -1.9680 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7669   -2.3691   -0.6543 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4050   -3.9647   -0.2847 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0197   -3.5654    1.0241 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1915    2.9882   -0.3114 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9589    3.3155    1.2846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7474    2.0811    2.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4617    3.4150    1.5536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2650    3.1244    0.3077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9404    1.6750   -0.3183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9160    3.3891   -1.6156 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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  1  0
 21 22  2  0
 21 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 20 39  1  0
 39 40  1  0
 17 41  1  0
 41 42  1  0
 42  2  1  0
 12  7  1  0
 40 17  1  0
 30 25  1  0
 35 31  1  0
 38 36  1  0
  3 43  1  0
  3 44  1  0
  4 45  1  0
  4 46  1  0
  5 47  1  0
  5 48  1  0
  8 49  1  0
  9 50  1  0
 10 51  1  0
 11 52  1  0
 13 53  1  0
 13 54  1  0
 14 55  1  0
 14 56  1  0
 15 57  1  0
 15 58  1  0
 16 59  1  0
 16 60  1  0
 18 61  1  0
 18 62  1  0
 19 63  1  0
 19 64  1  0
 23 65  1  0
 23 66  1  0
 26 67  1  0
 27 68  1  0
 28 69  1  0
 29 70  1  0
 32 71  1  0
 36 72  1  0
 37 73  1  0
 37 74  1  0
 38 75  1  0
 38 76  1  0
 39 77  1  0
 39 78  1  0
 40 79  1  0
 40 80  1  0
 41 81  1  0
 41 82  1  0
 42 83  1  0
M  END
$$$$
