
     RDKit          2D

 55 59  0  0  0  0  0  0  0  0999 V2000
   -9.0009   -5.2431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7230   -4.4575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7644   -2.9581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4865   -2.1725    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5279   -0.6731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7653    0.1748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3413    1.6136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2561    2.8023    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.6840    4.1889    0.0000 N   0  0  0  0  0  4  0  0  0  0  0  0
   -7.1120    5.5756    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8419    1.6550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9940    2.8923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4985    2.7768    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6506    4.0141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2983    5.3671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1551    3.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1825    5.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2041    4.4685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0885    2.9729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3695    2.6207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9416    1.2341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4285    1.0362    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0268    0.0453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5988   -1.3413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3160   -2.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2561   -3.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6587   -5.1054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1456   -4.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7177   -3.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8029   -2.3322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4601    0.2432    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0322    1.6298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7133    2.3604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5191    1.8277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0912    3.2143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5780    3.4122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1501    4.7989    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6309    2.3439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4339    0.6390    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9208    0.8369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6576    2.1434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8356   -0.3519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3225   -0.1540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2373   -1.3427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7242   -1.1449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6390   -2.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0669   -3.7202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5801   -3.9181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6652   -2.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3392    0.2417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1673   -2.8864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8895   -2.1009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1259   -4.3859    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4038   -5.1714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3624   -6.6708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  5  4  1  1
  5  6  1  0
  6  7  1  0
  7  8  1  6
  8  9  1  0
  9 10  3  0
  7 11  1  0
 11 12  1  1
 12 13  1  0
 13 14  1  0
 14 15  2  0
 16 14  1  6
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 21 23  1  0
 23 24  1  1
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 23 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  6
 35 36  1  0
 36 37  1  0
 36 38  2  0
 34 39  1  0
 39 40  1  0
 40 41  2  0
 40 42  1  0
 42 43  1  0
 43 44  1  0
 44 45  2  0
 45 46  1  0
 46 47  2  0
 47 48  1  0
 48 49  2  0
 11 50  1  0
  4 51  1  0
 51 52  2  0
 51 53  1  0
 53 54  1  0
 54 55  2  0
 54  2  1  0
 50  5  1  0
 20 16  1  0
 30 25  1  0
 49 44  1  0
M  CHG  2   8  -1   9   1
M  END
$$$$
