NC-ADC
     RDKit          2D

 86 89  0  0  1  0  0  0  0  0999 V2000
   -3.7644   -5.3391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5718   -0.9572    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7014   -3.2969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3728   -9.7978    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5137   -0.4967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9785   -9.0140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6768    2.9555    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2923   -3.4886    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3842    1.8430    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7815   -7.7440    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0858    3.1472    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3071    6.1390    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3387   -4.9879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7789   -5.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1529   -5.9066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6227   -4.1669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7039   -2.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3557   -7.3928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0333    1.1908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0522   -2.6448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9227   -0.3051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1628   -1.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7932    2.0346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7442   -7.9603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1700   -8.3115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4423    1.3825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9038    3.5305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6243    0.9992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9752    1.6513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4948    3.3389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5787   -6.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2022    2.2263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2153    0.8075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958   -8.6627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3317   -0.1134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2073   -8.0952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5662    1.4596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1047   -0.6884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7985  -10.1490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4367    3.7993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5473    5.2952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0045   -6.6090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8981    5.9474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0088    7.4433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1383    5.1036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3840   -6.0415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1902   -5.6903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5868   -4.5553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9874   -4.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4011   -3.6365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4178    7.6349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9563    5.4869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7161    6.3307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8457    3.9910    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3653    5.6786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1252    6.5224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7743    5.8703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5342    6.7140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8167    6.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0568    6.9057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4077    6.2536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6478    7.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9987    6.4453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2388    7.2891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5897    6.6369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8298    7.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1807    6.8286    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5022    7.5381    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.5854    6.5005    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9333    5.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4471    5.3525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6428    3.8281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8531    2.5528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5626    1.2313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7729   -0.0440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4824   -1.3656    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6927   -2.6408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1934   -2.5945    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.4036   -3.8698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1132   -5.1914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6125   -5.2377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4022   -3.9624    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9044   -3.8235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1948   -2.5019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3220   -6.5592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5323   -7.8345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0
  1 31  1  0
  2 21  1  0
  2 35  1  0
  3 20  2  0
  4 25  2  0
  5 28  2  0
  6 36  1  0
  7 40  2  0
  8 13  1  0
  8 17  1  0
  8 20  1  0
  9 19  1  0
  9 28  1  0
  9 30  1  0
 10 25  1  0
 10 34  1  0
 11 29  1  0
 11 40  1  0
 12 41  1  0
 12 51  1  0
 12 52  1  0
 13 14  1  0
 13 15  1  0
 14 16  1  0
 15 18  1  0
 16 17  1  0
 18 24  1  0
 18 25  1  0
 19 21  1  0
 19 23  1  0
 20 22  1  0
 21 22  1  0
 23 26  1  0
 23 27  1  0
 26 32  1  0
 28 29  1  0
 29 33  1  0
 33 37  1  0
 33 38  1  0
 34 36  1  0
 34 39  1  0
 36 42  1  0
 40 41  1  0
 41 43  1  0
 42 46  2  0
 42 47  1  0
 43 44  1  0
 43 45  1  0
 46 48  1  0
 47 49  2  0
 48 50  2  0
 49 50  1  0
 52 53  1  0
 52 54  2  0
 53 55  1  0
 55 56  1  0
 56 57  1  0
 57 58  1  0
 58 59  1  0
 59 60  1  0
 60 61  1  0
 61 62  1  0
 62 63  1  0
 63 64  1  0
 64 65  1  0
 65 66  1  0
 66 67  1  0
 67 71  1  0
 67 68  1  0
 68 69  2  0
 69 70  1  0
 70 71  2  0
 70 72  1  0
 72 73  1  0
 73 74  1  0
 74 75  1  0
 75 76  1  0
 76 77  1  0
 77 82  1  0
 77 78  2  0
 78 79  1  0
 79 80  2  0
 79 83  1  0
 80 81  1  0
 81 82  2  0
 81 85  1  0
 83 84  2  0
 85 86  2  0
M  END
>  <s_m_entry_id>  (1) 
19

>  <s_m_entry_name>  (1) 
entry

>  <r_f3d_energy>  (1) 
0

>  <i_f3d_flags>  (1) 
0

$$$$
