
     RDKit          3D

 82 86  0  0  0  0  0  0  0  0999 V2000
   -5.6805    2.8825    1.4750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0350    2.4310    1.1126 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3714    2.7087   -0.2992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6755    1.7492   -1.2754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9574    0.2926   -0.9076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5762    0.0139    0.5573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9421   -1.4278    0.9832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1330   -2.5147    0.2601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6961   -2.3264    0.4679 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7427   -2.3303   -0.6090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1511   -2.2793   -1.8013 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2805   -2.3546   -0.3422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7661   -2.8469    0.8684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3895   -2.8640    1.1031 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5121   -2.4056    0.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0061   -1.9157   -1.0991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3828   -1.8975   -1.3212 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9325   -1.4158   -2.1833 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5706   -0.0956   -1.8266 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8158    0.9544   -1.2709 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4339    2.1568   -0.9199 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8027    2.3319   -1.1361 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5567    1.3171   -1.7444 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9306    0.1130   -2.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0422    1.4821   -1.9122 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7404    1.0757   -0.6680 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0372    1.7720   -0.5223 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8082    3.2049   -0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9728    3.8117    0.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7235    3.3527    1.5016 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8742   -0.4018   -0.5651 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9192   -0.9319    0.5112 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9162   -2.4670    0.5462 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9257   -3.0190    1.5898 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5956   -3.4865    0.9863 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8983   -2.4036    0.3618 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2894    1.0237    1.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5851    3.9751    1.2977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8969    2.3582    0.8908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4952    2.7086    2.5567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1062    3.7568   -0.5598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4721    2.6227   -0.4304 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0495    1.9433   -2.3036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5803    1.9328   -1.2813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0356    0.0738   -1.0693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3662   -0.3540   -1.5888 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4795    0.1439    0.6739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0255   -1.6078    0.8056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7662   -1.5417    2.0765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4216   -3.5033    0.6753 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3928   -2.5324   -0.8186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3679   -2.1848    1.4496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4195   -3.2382    1.6351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0428   -3.2095    2.0671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7659   -1.5149   -2.2602 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3908   -1.2913   -3.1462 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7089   -2.1919   -2.3612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2448    0.8362   -1.0901 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8541    2.9505   -0.4687 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2740    3.2574   -0.8288 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5099   -0.6776   -2.5664 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2378    2.5487   -2.1573 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4107    0.9099   -2.7936 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6969    1.2353    0.1963 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5774    1.8080   -1.4949 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2121    3.9351   -0.5965 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0590    4.9156    0.6738 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8568    3.1576    0.9229 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8588    2.4195    2.0906 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0609    4.1774    1.8404 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6593   -0.9094   -1.5315 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9063   -0.7192   -0.2954 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2428   -0.5397    1.5010 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8898   -0.5659    0.3227 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6867   -2.8763   -0.4648 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9418   -2.8079    0.8162 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7279   -2.2725    2.3911 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3947   -3.8997    2.0826 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0011   -3.9211    1.8132 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7723   -4.2893    0.2393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9750    0.8498    2.5396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3873    0.8422    1.4541 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  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 16 18  1  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 26 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
  6 37  1  0
 37  2  1  0
 17 12  1  0
 24 19  1  0
 30 28  1  0
 36 15  1  0
  1 38  1  0
  1 39  1  0
  1 40  1  0
  3 41  1  0
  3 42  1  0
  4 43  1  0
  4 44  1  0
  5 45  1  0
  5 46  1  0
  6 47  1  0
  7 48  1  0
  7 49  1  0
  8 50  1  0
  8 51  1  0
  9 52  1  0
 13 53  1  0
 14 54  1  0
 17 55  1  0
 18 56  1  0
 18 57  1  0
 20 58  1  0
 21 59  1  0
 22 60  1  0
 24 61  1  0
 25 62  1  0
 25 63  1  0
 27 64  1  0
 27 65  1  0
 28 66  1  0
 29 67  1  0
 29 68  1  0
 30 69  1  0
 30 70  1  0
 31 71  1  0
 31 72  1  0
 32 73  1  0
 32 74  1  0
 33 75  1  0
 33 76  1  0
 34 77  1  0
 34 78  1  0
 35 79  1  0
 35 80  1  0
 37 81  1  0
 37 82  1  0
M  END
$$$$
