
     RDKit          3D

 50 53  0  0  0  0  0  0  0  0999 V2000
    7.2669   -0.2206    1.8175 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5353   -0.3356    1.4292 S   0  0  0  0  0  6  0  0  0  0  0  0
    4.7323    0.2129    2.5752 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1707   -1.7769    1.2090 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1987    0.6052   -0.0491 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7398    0.5241   -0.4008 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8301    1.4499    0.1320 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4687    1.3402   -0.1780 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0468    0.3320   -0.9881 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9017   -0.5924   -1.5077 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2661   -0.5094   -1.2222 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4215   -1.6354   -2.3108 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0313   -1.8275   -2.5751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7023   -2.2804   -1.2984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0903   -1.6508   -1.1556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4689   -1.7032    0.2170 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6613   -1.1742    0.7188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5505   -2.0623    1.3378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7567   -1.6073    1.8709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6114   -2.4808    2.4581 F   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0790   -0.2532    1.8064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1949    0.6493    1.2127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9763    0.2094    0.6578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0461    1.2242    0.0913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6904    1.2549    0.4686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8520    2.2612   -0.0357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3566    3.2091   -0.8682 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6558    3.1990   -1.2607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5209    2.2054   -0.8004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8065    2.1945   -1.2359 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5328    2.3071    0.3194 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4815   -0.8042    2.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5403    0.8418    1.9835 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8639   -0.6269    0.9751 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8194    0.2083   -0.8808 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4977    1.6622    0.1176 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1771    2.2475    0.7778 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9469   -1.2482   -1.6269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3889   -0.8857   -2.9910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0806   -2.6084   -3.3567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7960   -3.3882   -1.2933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1035   -2.0109   -0.4017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8243   -2.2152   -1.7701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0758   -0.6007   -1.5064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3052   -3.1153    1.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0098    0.1025    2.2294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4533    1.7010    1.2107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2929    0.5208    1.1585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0167    3.9620   -1.9374 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8972    3.1897    0.7438 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  2  0
  2  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
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  1  0
 19 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 26 31  1  0
 11  6  1  0
 23 17  1  0
 29 24  1  0
 31  8  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  5 35  1  0
  5 36  1  0
  7 37  1  0
 11 38  1  0
 13 39  1  0
 13 40  1  0
 14 41  1  0
 14 42  1  0
 15 43  1  0
 15 44  1  0
 18 45  1  0
 21 46  1  0
 22 47  1  0
 25 48  1  0
 28 49  1  0
 31 50  1  0
M  END
$$$$
