
     RDKit          3D

 55 58  0  0  0  0  0  0  0  0999 V2000
   -2.9792   -2.6248    2.0251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9850   -1.5248    1.0583 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6269   -1.7904   -0.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0980   -1.8723   -0.4871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6016   -1.4187   -1.8740 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7557   -0.6923   -1.8000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7690    0.6332   -1.1262 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0548    1.2646   -0.9041 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1214    2.4935   -0.6275 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3162    0.5042   -0.9839 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7634    0.1196   -2.2103 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9192   -0.5728   -2.3780 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6994   -0.9133   -1.2745 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2795   -0.5398    0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0470   -0.8796    1.1327 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6193   -0.5148    2.4111 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4246    0.1879    2.5776 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6502    0.5346    1.4674 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0696    0.1809    0.1685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4471    1.4229   -0.8267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6127    1.6599    0.6865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7721    2.4501    0.9660 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0706    2.1561    0.5205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7670    3.1699   -0.1497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0309    2.9293   -0.6909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6210    1.6719   -0.5560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2075    1.3690   -1.2404 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.9563    0.6609    0.1428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6874    0.8924    0.7011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0897   -0.1676    1.5365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7074    0.1189    2.7038 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8428   -3.6042    1.5186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9449   -2.6440    2.5726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1480   -2.4891    2.7491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0856   -2.7448   -0.6809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0477   -1.0001   -0.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7718   -2.9194   -0.3029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6154   -1.2709    0.3053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4670   -2.3292   -2.4983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3363   -0.8041   -2.4327 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1292   -0.5614   -2.8385 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4617   -1.3760   -1.2792 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2344   -0.8578   -3.3728 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6201   -1.4654   -1.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9747   -1.4288    1.0235 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2140   -0.7803    3.2756 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0962    0.4638    3.5715 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7258    1.0724    1.6337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3625    0.9445   -1.2090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3838    2.4054   -1.3429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6482    0.7082    1.2416 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2668    2.2099    1.0767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3098    4.1428   -0.2788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5470    3.7194   -1.2215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4409   -0.2996    0.2731 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  2  0
  8 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
  7 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 26 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 30  2  1  0
 19 10  1  0
 29 23  1  0
 19 14  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  3 35  1  0
  3 36  1  0
  4 37  1  0
  4 38  1  0
  5 39  1  0
  5 40  1  0
  6 41  1  0
  6 42  1  0
 12 43  1  0
 13 44  1  0
 15 45  1  0
 16 46  1  0
 17 47  1  0
 18 48  1  0
 20 49  1  0
 20 50  1  0
 21 51  1  0
 21 52  1  0
 24 53  1  0
 25 54  1  0
 28 55  1  0
M  END
$$$$
