
     RDKit          3D

 45 48  0  0  0  0  0  0  0  0999 V2000
    6.0215    0.1839   -0.3816 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0193   -0.7786    0.0571 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6204   -0.4627    0.0641 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1698    0.7485   -0.3876 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8330    1.0631   -0.4046 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9119    0.1686    0.0752 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3542   -1.0282    0.5356 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6675   -1.3709    0.5230 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8193   -2.5955    1.0629 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5566   -2.9510    1.4076 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2839   -4.0423    1.9797 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6234   -2.0131    1.0918 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7738   -1.9588    1.5328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6976   -1.6371    0.3859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8944   -2.5818   -0.6450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7819   -2.3071   -1.6897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4653   -1.0855   -1.7225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2931   -0.1392   -0.6974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4089   -0.4270    0.3625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0353    1.0544   -0.7621 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2439    1.9668    0.3217 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0288    2.8768    0.5779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1531    2.8550   -0.5368 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8020    2.8936   -0.1265 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0772    2.5567   -1.3313 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4239    2.2925   -0.9411 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0714    1.0267    0.3430 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7696    0.5651   -1.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0182   -0.3069   -0.4215 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3450   -1.7250    0.3702 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6983   -3.1352    1.2256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0776   -2.9371    1.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8639   -1.2035    2.3435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3815   -3.5362   -0.6179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9611   -3.0523   -2.4584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1601   -0.8856   -2.5300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2776    0.2765    1.1741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5143    1.4075    1.2463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1214    2.6018    0.0642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5552    2.5637    1.5404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3845    3.9185    0.7298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6013    2.1472    0.6717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5432    3.9091    0.2502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3345    1.6698   -1.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0703    3.4145   -2.0448 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
  8  3  1  0
 19 14  2  0
 26  5  1  0
 12  7  1  0
  1 27  1  0
  1 28  1  0
  1 29  1  0
  2 30  1  0
  9 31  1  0
 13 32  1  0
 13 33  1  0
 15 34  1  0
 16 35  1  0
 17 36  1  0
 19 37  1  0
 21 38  1  0
 21 39  1  0
 22 40  1  0
 22 41  1  0
 24 42  1  0
 24 43  1  0
 25 44  1  0
 25 45  1  0
M  END
$$$$
