
     RDKit          3D

 88 91  0  0  0  0  0  0  0  0999 V2000
   -9.1161    1.8273   -1.5158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4375    1.2948   -0.2567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9274    1.1403   -0.4653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2427    0.6443    0.8140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8018    0.4562    0.5899 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9416    1.6550    0.5848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2021    1.8334   -0.7424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0983    2.7110   -0.5289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2749    3.2428   -1.5318 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9593    4.6051   -1.4348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1698    5.2271   -2.4030 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3272    4.4899   -3.4763 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0491    3.1258   -3.5750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7313    2.4796   -2.6007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9253    1.0230   -2.7404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4004    0.5809   -3.8220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5558    0.0872   -1.7134 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3566    0.3940   -0.6043 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7841    0.2478   -1.0622 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0701   -0.5545   -1.9932 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8212    0.9905   -0.4062 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2255    0.9208   -0.8057 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8453   -0.4167   -0.3874 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2346   -0.4174   -0.6625 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9859   -0.0015    0.4647 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4754   -1.2224    1.2588 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3082   -0.8092    2.4673 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7129   -1.0001    1.9929 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5676   -2.0763    0.9386 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2585   -2.0441    0.4179 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0851   -0.5418    0.5952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9996   -0.0140    1.5028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7307    0.9760    2.2320 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2992   -0.6238    1.6233 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9575   -1.4244    0.5869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0921   -2.8810    1.0844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7472   -3.5386    1.2538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1337   -4.1788    0.1629 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1385   -4.7403    0.3018 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8089   -4.6624    1.5256 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2087   -4.0224    2.6132 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0642   -3.4605    2.4797 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3301   -0.8664    0.2200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0851   -1.5934   -0.4833 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7244    2.8364   -1.7657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9388    1.1420   -2.3720 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2107    1.9050   -1.3457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6326    1.9987    0.5823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8803    0.3077    0.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7418    0.4166   -1.2885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4938    2.1211   -0.7583 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4016    1.3777    1.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7069   -0.3114    1.1443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2345    1.6237    1.4317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5469    2.5708    0.7601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8897    2.2675   -1.5008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8553    0.8536   -1.1030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3464    5.1913   -0.6093 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0547    6.2832   -2.3235 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9385    4.9730   -4.2274 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4632    2.5652   -4.4053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7293   -0.9206   -1.9297 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2183    1.4435   -0.2751 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5593    1.6439    0.3688 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7801    1.7500   -0.3144 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3139    1.0598   -1.9057 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3837   -1.2295   -0.9869 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6073   -0.6433    0.6788 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4292    0.7000    1.1313 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8683    0.5625    0.0939 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5912   -1.7997    1.6065 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1260    0.2365    2.7982 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1026   -1.4994    3.3163 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3895   -1.3135    2.8159 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0870   -0.0596    1.5295 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3010   -1.9155    0.1197 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7502   -3.0768    1.3884 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0045   -0.6314    1.2145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1371   -1.5678    0.2472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8301   -0.4531    2.5078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3593   -1.4256   -0.3439 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6500   -2.8993    2.0473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6862   -3.4822    0.3611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6345   -4.2284   -0.7964 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6081   -5.2289   -0.5422 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7954   -5.0939    1.6303 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7314   -3.9586    3.5588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5131   -2.9542    3.3248 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  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 18 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  2  0
 40 41  1  0
 41 42  2  0
 35 43  1  0
 43 44  2  0
 43  5  1  0
 14  9  1  0
 30 26  1  0
 42 37  1  0
  1 45  1  0
  1 46  1  0
  1 47  1  0
  2 48  1  0
  2 49  1  0
  3 50  1  0
  3 51  1  0
  4 52  1  0
  4 53  1  0
  6 54  1  0
  6 55  1  0
  7 56  1  0
  7 57  1  0
 10 58  1  0
 11 59  1  0
 12 60  1  0
 13 61  1  0
 17 62  1  0
 18 63  1  0
 21 64  1  0
 22 65  1  0
 22 66  1  0
 23 67  1  0
 23 68  1  0
 25 69  1  0
 25 70  1  0
 26 71  1  0
 27 72  1  0
 27 73  1  0
 28 74  1  0
 28 75  1  0
 29 76  1  0
 29 77  1  0
 31 78  1  0
 31 79  1  0
 34 80  1  0
 35 81  1  0
 36 82  1  0
 36 83  1  0
 38 84  1  0
 39 85  1  0
 40 86  1  0
 41 87  1  0
 42 88  1  0
M  END
$$$$
