
     RDKit          3D

 94 98  0  0  0  0  0  0  0  0999 V2000
   -1.3609    2.3058   -3.1452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0593    1.9389   -1.7581 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6461    2.7286   -0.6641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1712    2.6395   -0.6835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6839    3.0754    0.5741 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0175    3.4099    0.8685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2228    4.1905    2.0155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5032    4.6195    2.3695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6005    4.2638    1.5871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4216    3.4737    0.4494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1436    3.0205    0.0897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0595    2.0857   -1.0435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1437    2.5419   -2.2142 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9352    0.6693   -0.8479 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0115    0.0014    0.4568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6863   -0.6894    0.8098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3536   -1.8299   -0.1549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1976   -2.5246    0.3046 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6925   -3.7001   -0.2782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2371   -4.2352   -1.4643 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7481   -5.4339   -1.9878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7109   -6.1098   -1.3400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1545   -5.5848   -0.1720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6269   -4.3737    0.3551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0237   -3.8363    1.5879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8787   -4.5960    2.5850 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5926   -2.4690    1.6787 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0567   -1.7840    0.5536 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4573   -2.3266    0.3830 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1196   -2.6693    1.4006 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0484   -2.4176   -0.9231 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3161   -3.1038   -1.1806 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4577   -2.5320   -0.3707 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4296   -3.3964    0.1594 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4951   -2.8907    0.9061 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6020   -1.5176    1.1334 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6558   -0.6352    0.5880 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7637    0.8424    0.8612 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0620    1.3655    0.3783 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4646    2.6013    1.0826 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7025    3.8241    0.5525 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9177    3.9750   -0.8350 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3856    2.8574   -1.5211 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0933    1.5594   -1.0905 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5977   -1.1460   -0.1812 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0678   -0.2605    0.8185 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6135    0.5895   -0.3463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3574    0.7070   -1.4954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5005   -0.2709   -2.2790 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4255    3.4139   -3.2471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5609    1.9425   -3.8268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3314    1.8529   -3.4480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2877    2.3736    0.3237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3344    3.7914   -0.7624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5618    3.2840   -1.4982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4616    1.5875   -0.8657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3764    4.4818    2.6278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6438    5.2283    3.2532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5947    4.5900    1.8676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2883    3.1918   -0.1396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8665    0.0716   -1.7014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2632    0.7191    1.2665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8305   -0.7499    0.4315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8580    0.0502    0.8194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7728   -1.1080    1.8371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2136   -2.5333   -0.1966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1512   -1.4257   -1.1698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0443   -3.7336   -1.9837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1735   -5.8435   -2.8967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3389   -7.0454   -1.7412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3453   -6.1169    0.3164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4197   -2.1001    2.6423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5249   -1.9811   -0.3696 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5061   -2.0749   -1.7477 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5706   -3.0177   -2.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1836   -4.1849   -0.9532 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3611   -4.4638   -0.0064 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2351   -3.5664    1.3149 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4248   -1.1402    1.7283 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6778    0.9679    1.9645 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9104    1.3978    0.4163 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3134    2.5087    2.1815 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5527    2.7621    0.9300 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0864    4.7311    1.0679 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6162    3.7498    0.7830 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2833    2.7895   -1.3793 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5550    3.0043   -2.6085 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6385    0.6932   -1.6188 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1535    1.6110   -1.4176 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8789   -0.4667   -0.6193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9651    0.0746    1.0565 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6900   -0.0570    1.7200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5752    0.1835   -0.7166 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8559    1.6044    0.0374 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  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 12 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  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  1  0
 41 42  1  0
 42 43  1  0
 43 44  1  0
 37 45  2  0
 28 46  1  0
 46 47  1  0
 47 48  1  0
 48 49  2  0
 48  2  1  0
 11  6  1  0
 24 19  1  0
 45 33  1  0
 44 39  1  0
  1 50  1  0
  1 51  1  0
  1 52  1  0
  3 53  1  0
  3 54  1  0
  4 55  1  0
  4 56  1  0
  7 57  1  0
  8 58  1  0
  9 59  1  0
 10 60  1  0
 14 61  1  0
 15 62  1  0
 15 63  1  0
 16 64  1  0
 16 65  1  0
 17 66  1  0
 17 67  1  0
 20 68  1  0
 21 69  1  0
 22 70  1  0
 23 71  1  0
 27 72  1  0
 28 73  1  0
 31 74  1  0
 32 75  1  0
 32 76  1  0
 34 77  1  0
 35 78  1  0
 36 79  1  0
 38 80  1  0
 38 81  1  0
 40 82  1  0
 40 83  1  0
 41 84  1  0
 41 85  1  0
 43 86  1  0
 43 87  1  0
 44 88  1  0
 44 89  1  0
 45 90  1  0
 46 91  1  0
 46 92  1  0
 47 93  1  0
 47 94  1  0
M  END
$$$$
