
     RDKit          3D

 57 60  0  0  0  0  0  0  0  0999 V2000
    8.2778    1.1580   -0.4075 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2128    0.2164    0.0408 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8980    0.4202   -0.1825 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3198   -0.6409    0.4134 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8688   -0.9129    0.4222 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4652   -2.0429    0.8092 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9079    0.0687   -0.0143 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1394    1.5018    0.1579 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8169    2.1944    0.4782 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8084    1.8556   -0.4615 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4974    0.4633   -0.4627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5771    0.2388   -1.5620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0937   -1.2203   -1.7247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6265   -1.3521   -1.5772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0423   -1.7868   -0.1604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4691   -1.3996    0.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5239   -2.1501   -0.4013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8509   -1.7930   -0.1458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1371   -0.6823    0.6515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0971    0.0761    1.1943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7647   -0.2726    0.9426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7381    0.5001    1.4889 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2185    1.6303    0.7964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7864    1.9516    1.2487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0529    0.7446    1.6479 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0616    0.0113    0.8953 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3554   -1.0728    1.3879 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7802   -0.3310   -0.8585 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2955   -1.4442    0.9648 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4525   -0.8813    0.7222 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9504    1.6961   -1.3218 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4822    1.8936    0.3979 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2068    0.5942   -0.6330 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5642    1.9223   -0.7792 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8464    1.6894    0.9950 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5007    1.9636    1.5186 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9770    3.2922    0.4359 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4110    0.9396   -1.3911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1536    0.5663   -2.5379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8180   -1.5655   -2.7457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5907   -1.9242   -1.0297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9877   -2.1269   -2.2888 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1334   -0.4081   -1.8717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3655   -1.3513    0.5972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9304   -2.8894   -0.0696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3171   -3.0111   -1.0249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6584   -2.3771   -0.5680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1656   -0.4078    0.8471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3246    0.9380    1.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8749    2.5070    0.9831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2355    1.4414   -0.2944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2668    2.5160    0.4544 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8402    2.6274    2.1295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3267    0.3342    2.5697 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6114   -1.4268   -0.7965 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0487   -0.1087   -1.9148 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1560   -2.3727    1.5028 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  2  0
 11 28  1  0
  4 29  2  0
 29 30  1  0
 30  2  1  0
 28  7  1  0
 26 11  1  0
 21 16  1  0
  1 31  1  0
  1 32  1  0
  1 33  1  0
  8 34  1  0
  8 35  1  0
  9 36  1  0
  9 37  1  0
 12 38  1  0
 12 39  1  0
 13 40  1  0
 13 41  1  0
 14 42  1  0
 14 43  1  0
 15 44  1  0
 15 45  1  0
 17 46  1  0
 18 47  1  0
 19 48  1  0
 20 49  1  0
 23 50  1  0
 23 51  1  0
 24 52  1  0
 24 53  1  0
 25 54  1  0
 28 55  1  0
 28 56  1  0
 29 57  1  0
M  END
$$$$
