
     RDKit          3D

 72 73  0  0  0  0  0  0  0  0999 V2000
   -5.6954    3.6847   -0.3266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9916    2.4339   -0.8682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9914    1.5784   -1.6607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3485    1.6457    0.2998 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4094    0.5031   -0.1557 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2973    1.0146   -0.9656 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3738    2.0030   -0.4932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5745    3.2188   -0.7614 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1177    1.5838    0.2217 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0416    2.3493    1.5373 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0510    1.8175   -0.6374 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3399    1.1899   -0.4904 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3109    1.6642   -1.1380 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5588   -0.0741    0.3293 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5482    0.1711    1.4926 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9613    0.4674    1.0471 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4278    1.7926    0.9969 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7354    2.0652    0.5834 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5878    1.0190    0.2204 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1347   -0.3016    0.2735 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8282   -0.5788    0.6872 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0194   -1.1913   -0.5193 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1239   -1.4294   -1.6703 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1225   -2.9025   -2.1174 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2442   -3.8180   -1.2414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2657   -3.5041   -1.3457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8077   -2.8346   -0.0732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2695   -2.4060   -0.2474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7512   -1.7252    0.9636 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9768   -2.5032    2.1844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8944   -0.2915    1.0255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6157    0.3087    2.0999 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5008    3.4035    0.3856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9668    4.3389    0.1976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1408    4.2685   -1.1605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1969    2.7754   -1.5662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5127    2.1985   -2.4208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7502    1.1313   -0.9842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4679    0.7683   -2.2069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7674    2.3517    0.9342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1541    1.2207    0.9398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0111   -0.1930   -0.7754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2802    0.7845   -1.9852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2318    0.5069    0.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2386    3.4245    1.3407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8760    2.2621    2.1546 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8905    1.9320    2.1161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9997    2.6088   -1.3200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6201   -0.3888    0.8191 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1695    1.0025    2.1264 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5621   -0.7273    2.1488 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7776    2.6136    1.2736 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0872    3.0882    0.5445 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5996    1.2317   -0.0991 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7964   -1.1121   -0.0034 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4954   -1.6082    0.7323 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0491   -2.0454    0.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0852   -1.0894   -1.4736 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4959   -0.8198   -2.5219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1659   -3.2860   -2.1152 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7623   -2.9602   -3.1680 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4050   -4.8599   -1.5944 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5898   -3.7966   -0.1856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4743   -2.8649   -2.2317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8212   -4.4558   -1.4986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7283   -3.5519    0.7719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2010   -1.9436    0.1829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9030   -3.2977   -0.4468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3449   -1.7443   -1.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9967   -2.2992    2.5740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2259   -2.2243    2.9542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8926   -3.5937    1.9883 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
  7  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 14 22  1  0
 22 23  1  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
 29 30  1  0
 29 31  1  0
 31 32  2  0
 31  5  1  0
 21 16  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  2 36  1  0
  3 37  1  0
  3 38  1  0
  3 39  1  0
  4 40  1  0
  4 41  1  0
  5 42  1  6
  6 43  1  0
  9 44  1  1
 10 45  1  0
 10 46  1  0
 10 47  1  0
 11 48  1  0
 14 49  1  1
 15 50  1  0
 15 51  1  0
 17 52  1  0
 18 53  1  0
 19 54  1  0
 20 55  1  0
 21 56  1  0
 22 57  1  0
 23 58  1  0
 23 59  1  0
 24 60  1  0
 24 61  1  0
 25 62  1  0
 25 63  1  0
 26 64  1  0
 26 65  1  0
 27 66  1  0
 27 67  1  0
 28 68  1  0
 28 69  1  0
 30 70  1  0
 30 71  1  0
 30 72  1  0
M  END
$$$$
