
     RDKit          3D

 71 74  0  0  0  0  0  0  0  0999 V2000
   -1.4454    5.0624    0.9226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7893    3.6712    1.4454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7691    2.6916    0.3570 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9861    2.4389   -0.4280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8869    1.4043    0.2605 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2837    0.4065   -0.6774 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0520   -0.7062   -0.3153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2977   -0.5343    0.3076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0555   -1.6455    0.6804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5739   -2.9319    0.4390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3361   -3.1134   -0.1817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5692   -2.0051   -0.5718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1819   -2.2097   -1.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1267   -2.1091   -0.0137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7221   -1.7388   -0.5320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5593   -0.2355   -0.8561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1634    0.6794    0.3479 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3849    0.5977    0.6113 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7183   -0.5256    1.4970 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0277   -1.1358    1.4631 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5433   -1.5609    2.5338 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8120   -1.2539    0.2144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2070   -1.6653   -0.9852 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9691   -1.7952   -2.1498 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3390   -1.5247   -2.1258 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9617   -1.1266   -0.9330 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4364   -0.8108   -0.9048 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6526    0.5343   -0.5203 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5357    1.3864   -1.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1942   -1.0014    0.2369 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8482   -0.7630    2.6527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2737    0.2729    2.7012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9659    0.3147    1.4730 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5198    2.1045   -0.0437 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2557    2.7641   -0.7875 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4948    5.8013    1.7508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1736    5.3633    0.1373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4211    5.0750    0.4956 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7995    3.6986    1.9094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0617    3.3800    2.2319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7133    2.1107   -1.4545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5482    3.3882   -0.5589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7792    1.9160    0.6918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3466    0.9063    1.0961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6828    0.4594    0.4922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0190   -1.5117    1.1575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1642   -3.7939    0.7189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9719   -4.1206   -0.3532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1059   -3.2101   -1.6087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9987   -1.4689   -1.9392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0680   -3.0952    0.4991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4551   -1.3859    0.7586 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0355   -2.0535    0.2116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5169   -2.3252   -1.4530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5037    0.1266   -1.3116 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1999   -0.1354   -1.6620 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7296    1.5297    1.1126 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9429    0.5492   -0.3445 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1512   -1.8961   -1.0204 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4990   -2.1061   -3.0740 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9085   -1.6252   -3.0420 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9358   -1.0616   -1.8699 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9091   -1.4675   -0.1432 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5614    1.2551   -2.1553 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5922    2.4353   -1.2903 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3772    1.2270   -2.3461 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6742   -0.6946    1.1587 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4134   -1.7831    2.5861 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4273   -0.6932    3.5978 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1289    1.2766    2.9554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9900   -0.0068    3.5006 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  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  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  2  0
 20 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 26 30  2  0
 19 31  1  0
 31 32  1  0
 32 33  1  0
 17 34  1  0
 34 35  2  0
 34  3  1  0
 12  7  1  0
 33 17  1  0
 30 22  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  2 39  1  0
  2 40  1  0
  4 41  1  0
  4 42  1  0
  5 43  1  0
  5 44  1  0
  8 45  1  0
  9 46  1  0
 10 47  1  0
 11 48  1  0
 13 49  1  0
 13 50  1  0
 14 51  1  0
 14 52  1  0
 15 53  1  0
 15 54  1  0
 16 55  1  0
 16 56  1  0
 18 57  1  0
 18 58  1  0
 23 59  1  0
 24 60  1  0
 25 61  1  0
 27 62  1  0
 27 63  1  0
 29 64  1  0
 29 65  1  0
 29 66  1  0
 30 67  1  0
 31 68  1  0
 31 69  1  0
 32 70  1  0
 32 71  1  0
M  END
$$$$
