
     RDKit          3D

 86 89  0  0  0  0  0  0  0  0999 V2000
   -4.8440   -2.3365   -1.6820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4563   -3.3833   -0.7449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9283   -3.6764   -1.0769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1962   -3.1566    0.7771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8117   -3.5256    1.1181 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7765   -2.6385    1.5677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0900   -2.9627    2.5736 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3915   -1.4112    0.7987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1864   -1.7081   -0.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6926   -0.4942   -0.9296 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0808    0.4852   -0.0722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4882    1.0807    0.8817 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4575    0.7629   -0.3640 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2476    1.6720    0.4674 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6432    1.8190   -0.0814 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0778    3.0421   -0.6186 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3671    3.1618   -1.1443 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2274    2.0611   -1.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8085    0.8318   -0.6196 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7244   -0.3646   -0.6714 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9794   -0.1005    0.0631 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0409   -1.0287   -0.3869 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1405   -1.1662    0.6794 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6753   -1.6829    1.9212 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2941   -1.4434    2.1581 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7833   -0.1316    1.5342 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5170    0.7192   -0.0789 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7982    0.1541   -1.6475 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6325    1.4415   -2.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2339    1.5136   -3.4427 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8890    2.6794   -1.4791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1477    3.8366   -1.7768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3456    5.0114   -1.0511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2864    5.0486   -0.0234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0382    3.9122    0.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8659    2.7231   -0.4576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6330    1.5780   -0.1769 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0195    1.5961    0.1777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2976    0.5902    1.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9605   -0.6306    0.8176 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3141   -0.4764    0.2680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6389   -1.8702    1.4800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7074   -1.9012    2.7409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1321   -2.5475   -2.7329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1584   -1.3056   -1.4425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7400   -2.4015   -1.6350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9350   -4.3340   -1.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5835   -2.8071   -0.9124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3020   -4.5182   -0.4546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0253   -3.9816   -2.1414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8224   -3.9324    1.2726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6175   -4.5489    1.2234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1391   -0.6151    1.5255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2446   -1.0616    0.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4687   -2.5179   -0.8187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3433   -2.0956    0.5049 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0024   -0.9005   -1.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8960    0.3127   -1.1965 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3028    1.2696    1.5016 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7379    2.6590    0.5147 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4177    3.9002   -0.6353 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6960    4.1055   -1.5586 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2185    2.1624   -1.5772 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2264   -1.2771   -0.2720 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9414   -0.5617   -1.7453 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4911   -0.6388   -1.3242 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6297   -2.0430   -0.5954 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6111   -0.1722    0.8524 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9301   -1.8446    0.2900 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6991   -2.2987    1.7690 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1305   -1.4036    3.2558 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3473    0.7153    1.9810 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7178    0.0132    1.8185 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1826   -0.2274    0.3306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4622   -0.4797   -2.1441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3953    3.8259   -2.5568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7599    5.8928   -1.2782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4284    5.9577    0.5466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7320    3.9602    1.1068 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3460    2.6006    0.5128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6150    1.3642   -0.7296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9467    1.0663    2.0783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3472    0.3438    1.8286 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7184    0.5375    0.4765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2943   -0.5989   -0.8330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0154   -1.2049    0.7287 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 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
 19 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
 19 27  2  0
 10 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  2  0
 32 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  1  0
 40 42  1  0
 42 43  2  0
 42  4  1  0
 27 15  1  0
 36 31  1  0
 26 21  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  0
  3 48  1  0
  3 49  1  0
  3 50  1  0
  4 51  1  0
  5 52  1  0
  8 53  1  0
  8 54  1  0
  9 55  1  0
  9 56  1  0
 10 57  1  0
 13 58  1  0
 14 59  1  0
 14 60  1  0
 16 61  1  0
 17 62  1  0
 18 63  1  0
 20 64  1  0
 20 65  1  0
 22 66  1  0
 22 67  1  0
 23 68  1  0
 23 69  1  0
 25 70  1  0
 25 71  1  0
 26 72  1  0
 26 73  1  0
 27 74  1  0
 28 75  1  0
 32 76  1  0
 33 77  1  0
 34 78  1  0
 35 79  1  0
 38 80  1  0
 38 81  1  0
 39 82  1  0
 39 83  1  0
 41 84  1  0
 41 85  1  0
 41 86  1  0
M  END
$$$$
