
     RDKit          3D

 79 82  0  0  0  0  0  0  0  0999 V2000
   -3.6305    5.8203    2.1816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7844    4.4161    1.6057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8440    3.4244    2.3035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0605    1.9835    1.8186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7615    1.8197    0.3859 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8365    1.5550   -0.5846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5224    0.2015   -0.3558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6268   -0.8753   -0.6263 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9473   -2.2365   -0.4654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2495   -2.6535   -0.1209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5403   -4.0102    0.0393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5410   -4.9667   -0.1362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2461   -4.5714   -0.4745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9406   -3.2119   -0.6529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5238   -2.8146   -0.9831 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6621   -2.6720    0.2903 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2194   -1.4106    0.2640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5753   -0.1226    0.5998 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4561    1.0147   -0.4592 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0271    1.5507   -0.4540 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8346    0.8405   -1.4554 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2049    0.4501   -1.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9681    0.2562   -2.2070 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7579    0.2996    0.1766 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9432   -0.6259    0.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9296   -2.0070    0.3338 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7235   -2.8732    0.4974 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1910   -2.4791    0.2982 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0023   -1.4435    0.1476 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4513   -1.5701    0.0458 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2809   -0.3038    0.0648 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8527    1.0755   -0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2734    0.6851   -2.8016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2047    1.0759   -2.8122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8626    0.4750   -1.7163 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4421    2.1261   -0.1026 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1700    3.3263   -0.3753 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8861    5.8252    3.2624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5864    6.1791    2.0499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3164    6.5147    1.6524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5578    4.4538    0.5195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8393    4.0879    1.7325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0369    3.4502    3.3981 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862    3.7251    2.1478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1100    1.6997    2.0411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4094    1.3041    2.4070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5987    2.3609   -0.5097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4386    1.5773   -1.6239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3905    0.1332   -1.0470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9031    0.1231    0.6829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0457   -1.9367    0.0258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5432   -4.3204    0.3037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7685   -6.0169   -0.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4776   -5.3256   -0.5963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5345   -1.8820   -1.5795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0672   -3.5782   -1.6511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0020   -3.5632    0.3679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2873   -2.6643    1.2114 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7263   -1.3522   -0.7200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0163   -1.5345    1.0270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2429    0.2576    1.5917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6405   -0.3882    0.7398 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4625    1.4903    0.5629 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0728    2.6274   -0.7191 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9819   -0.1159    0.8505 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0453    1.2991    0.5644 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0117   -3.9445    0.4557 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9999   -2.6665   -0.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2465   -2.6678    1.4783 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9439   -0.8588    0.7415 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7654   -2.6008    0.3145 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7721   -1.3561   -0.9948 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1605    1.7197   -0.6637 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0089    1.5199    0.9221 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8210    1.0414   -0.6228 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8317    1.3201   -3.5223 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3636   -0.3779   -3.1133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6696    0.7097   -3.7513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3239    2.1826   -2.7958 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  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 26 28  2  0
 28 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 21 33  1  0
 33 34  1  0
 34 35  1  0
 19 36  1  0
 36 37  2  0
 36  5  1  0
 14  9  1  0
 35 19  1  0
 31 25  2  0
  1 38  1  0
  1 39  1  0
  1 40  1  0
  2 41  1  0
  2 42  1  0
  3 43  1  0
  3 44  1  0
  4 45  1  0
  4 46  1  0
  6 47  1  0
  6 48  1  0
  7 49  1  0
  7 50  1  0
 10 51  1  0
 11 52  1  0
 12 53  1  0
 13 54  1  0
 15 55  1  0
 15 56  1  0
 16 57  1  0
 16 58  1  0
 17 59  1  0
 17 60  1  0
 18 61  1  0
 18 62  1  0
 20 63  1  0
 20 64  1  0
 24 65  1  0
 24 66  1  0
 27 67  1  0
 27 68  1  0
 27 69  1  0
 30 70  1  0
 30 71  1  0
 30 72  1  0
 32 73  1  0
 32 74  1  0
 32 75  1  0
 33 76  1  0
 33 77  1  0
 34 78  1  0
 34 79  1  0
M  END
$$$$
