
     RDKit          3D

 79 83  0  0  0  0  0  0  0  0999 V2000
   -4.0248    4.9249   -2.3882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5714    4.7673   -1.9457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3251    3.4504   -1.1963 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8163    3.4917    0.2514 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5891    2.2009    0.9171 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7420    1.5216    1.5463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3607    0.4697    0.6075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3289   -0.8253    1.2180 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0556   -2.0117    0.5180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4632   -2.1622   -0.8216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1645   -3.3272   -1.5274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4548   -4.3558   -0.9077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0528   -4.2300    0.4229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3574   -3.0702    1.1577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8268   -2.9531    2.5752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3630   -2.4499    2.6016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2975   -0.9160    2.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0784   -0.3595    1.7306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4601    0.7154    0.6597 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8719    1.2838    0.0660 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4757    0.2911   -0.8273 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8968    0.0681   -0.8724 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4496   -0.1737   -1.9806 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7284    0.1194    0.3826 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9500   -0.7518    0.2603 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0052   -2.1318    0.4192 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8889   -3.0136    0.8825 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2331   -2.5950    0.0859 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8946   -1.4793   -0.2864 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2052   -1.4326   -0.7495 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7177   -0.1826   -1.1327 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9183    0.9720   -1.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6052    0.8685   -0.5674 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1500   -0.3607   -0.2012 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6068   -0.4385   -1.7513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8283    0.0777   -1.6410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3020    0.0707   -0.3069 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2405    1.8571    1.3130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6787    2.5527    2.2062 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6937    5.0429   -1.5118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1204    5.8341   -3.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3497    4.0497   -2.9861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9306    4.7830   -2.8541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2711    5.6315   -1.3131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2355    3.2735   -1.1884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8056    2.6037   -1.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8972    3.7399    0.2498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2899    4.2987    0.8103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5283    2.2633    1.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4392    1.0750    2.5217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8063    0.4617   -0.3543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4148    0.7215    0.3693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0166   -1.3766   -1.3198 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4759   -3.4285   -2.5576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2148   -5.2522   -1.4632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4917   -5.0366    0.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4831   -2.2928    3.1898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8605   -3.9573    3.0539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8878   -2.7554    3.5601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7916   -2.9457    1.7862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1827   -0.6012    1.9418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3711   -0.4515    3.4947 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4663   -1.1857    1.2183 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6267    0.0718    2.4762 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5685    1.5754    0.8837 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6794    2.2056   -0.5262 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0184    1.1721    0.5885 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1235   -0.2384    1.2451 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7421   -2.8887    1.9748 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9500   -2.7558    0.3512 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1343   -4.0707    0.6618 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8048   -2.3310   -0.8248 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7311   -0.1082   -1.5062 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3103    1.9347   -1.3541 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9779    1.7505   -0.5002 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9574   -0.2976   -2.7955 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6330   -1.5198   -1.5050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8980    1.0991   -2.0686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4833   -0.5766   -2.2519 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  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  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
 31 32  1  0
 32 33  2  0
 33 34  1  0
 21 35  1  0
 35 36  1  0
 36 37  1  0
 19 38  1  0
 38 39  2  0
 38  5  1  0
 14  9  1  0
 37 19  1  0
 34 25  1  0
 34 29  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  2 44  1  0
  3 45  1  0
  3 46  1  0
  4 47  1  0
  4 48  1  0
  6 49  1  0
  6 50  1  0
  7 51  1  0
  7 52  1  0
 10 53  1  0
 11 54  1  0
 12 55  1  0
 13 56  1  0
 15 57  1  0
 15 58  1  0
 16 59  1  0
 16 60  1  0
 17 61  1  0
 17 62  1  0
 18 63  1  0
 18 64  1  0
 20 65  1  0
 20 66  1  0
 24 67  1  0
 24 68  1  0
 27 69  1  0
 27 70  1  0
 27 71  1  0
 30 72  1  0
 31 73  1  0
 32 74  1  0
 33 75  1  0
 35 76  1  0
 35 77  1  0
 36 78  1  0
 36 79  1  0
M  END
$$$$
