
     RDKit          2D

 62 67  0  0  0  0  0  0  0  0999 V2000
   -4.5203    1.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6433    2.1391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4903    3.1195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9511    1.5591    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1269    1.8811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1935    1.6781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2123    0.4115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2795   -0.5163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7897   -0.8557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3961   -1.4809    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4877   -2.0431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5795   -1.6885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6529   -2.5791    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5433   -2.0957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2809   -1.1361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3649   -0.7873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2247    0.1831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3335    0.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0199    1.9075    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2103    1.8785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5255    1.6047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0383    2.8553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6561    3.5725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1897    4.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7955    4.2859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9403    3.2967    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9931    2.8281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7503    3.4273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5663   -0.0755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6337   -1.0545    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2327    0.3283    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4703   -0.4229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4657   -1.4273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7953   -2.0017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7379   -1.6923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4817   -2.3515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2805   -3.3287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3357   -3.6469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5915   -2.9829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8983   -0.2257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8601    0.3407    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5487   -0.8627    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3099   -0.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1339   -1.1857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0587   -2.1867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0251   -0.7747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3533    0.3619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2155    0.7555    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3511    0.9421    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9933    1.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8991    0.9387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9443   -0.0633    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.1073   -0.5921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2331   -0.1131    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2075    0.9243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0291    0.6107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8957   -1.2185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6123   -0.5241    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.7561   -1.7277    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.5419   -2.1507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4805   -2.4775    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.3487   -3.1367    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  5  4  1  6
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  1
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  1
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  2  0
 18 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  0
 32 33  1  1
 33 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  2  0
 37 38  1  0
 38 39  2  0
 32 40  1  0
 40 41  2  0
 40 42  1  0
 43 42  1  1
 43 44  1  0
 44 45  1  1
 44 46  1  0
 43 47  1  0
 47 48  2  0
 47 49  1  0
 49 50  1  0
 50 51  1  1
 51 52  1  0
 52 53  1  0
 53 54  1  0
 54 55  1  0
 55 56  2  0
 53 57  1  6
 57 58  1  0
 57 59  1  0
 57 60  1  0
 60 61  1  0
 60 62  1  0
 27  5  1  0
 39 34  1  0
 55 50  1  0
 60 14  1  0
 53 15  1  0
 26 22  1  0
M  END
