
     RDKit          2D

 57 60  0  0  0  0  0  0  0  0999 V2000
   -1.7228   13.9253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6443   12.4273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3078   11.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9023   11.6103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0170   12.6140    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4842   12.9259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5627   14.4239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9108   12.4624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6608   13.7614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0507   15.1317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1280   13.4496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2848   11.9578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9145   11.3477    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2264    9.8804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7243    9.8019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7628    8.4539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6481    7.4502    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1809    7.1383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1024    5.6404    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3604    4.8234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2819    3.3255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9454    2.6445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5399    2.5085    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4614    1.0105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1249    0.3296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8669    1.1465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0464   -1.1684    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7099   -1.8494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4519   -1.0324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1154   -1.7134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8574   -0.8964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0369   -3.2113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6314   -3.3473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7971   -4.2913    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2595   -5.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7616   -5.6132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3734   -4.1643    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7194    0.1936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6409   -1.3044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0559    0.8746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1344    2.3725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4709    3.0535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7289    2.2365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6504    0.7386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3139    0.0576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6969    5.5044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3596    6.9660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3779    4.1679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0334    6.1854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7543    7.6018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9374    6.3438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6793    7.1608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1954    5.5269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1204    5.0858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7506    8.7165    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4387   10.1838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9408   10.2623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  4  2  1  1
  4  5  1  0
  5  6  1  0
  6  7  2  0
  8  6  1  1
  8  9  1  0
  9 10  1  1
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  2  0
 20 19  1  6
 20 21  1  0
 21 22  2  0
 21 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  1  0
 28 29  1  6
 29 30  1  0
 30 31  2  0
 30 32  1  0
 28 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 24 38  1  0
 38 39  1  1
 38 40  1  0
 40 41  2  0
 41 42  1  0
 42 43  2  0
 43 44  1  0
 44 45  2  0
 20 46  1  0
 46 47  1  0
 46 48  1  0
 46 49  1  0
 18 50  1  0
 50 51  1  1
 51 52  1  0
 51 53  1  0
 51 54  1  0
 50 55  1  0
 55 56  1  0
 56 57  2  0
 56  4  1  0
 13  8  1  0
 37 33  1  0
 45 40  1  0
M  END
