
     RDKit          3D

 74 76  0  0  0  0  0  0  0  0999 V2000
    7.7351   -1.1057   -0.9446 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9907   -0.2801    0.1097 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1871   -1.1929    1.0464 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4170   -0.3523    2.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5125    0.6249    1.4321 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3105   -0.0048    0.8387 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1579    0.9691    0.7847 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2077    2.0134    1.4905 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9967    0.7221   -0.0433 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6211   -0.6467   -0.4352 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0130   -1.4071    0.7512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2691   -2.8856    0.4143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7111   -3.1402   -0.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0099   -2.4491   -1.3008 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3460   -2.1229   -1.7159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5679   -1.8642   -2.9289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4770   -2.1240   -0.7699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5305   -3.0293   -0.9722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5711   -3.1216   -0.0423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8736   -4.2701   -0.2930 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -6.5649   -2.3106    1.0955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5316   -1.3923    1.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5007   -1.2715    0.3551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5226   -0.2931    0.5616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3195    0.7888   -0.3455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0294    2.0685    0.4587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3287    3.4081   -0.2958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8196    3.4535   -1.7484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8330    3.7294   -0.2734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6808    2.0217    1.0487 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5121    2.5933    0.4509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0800    3.6954    0.8823 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2619    1.8642   -0.6094 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2356    1.5130    0.4912 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0597    0.7430   -0.5580 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3341   -0.4373   -1.5988 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0196   -1.6765   -1.5748 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4279   -1.8198   -0.4501 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7501    0.2697    0.7116 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4759   -1.8188    0.4634 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792   -1.8747    1.5872 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8477   -1.0233    2.7532 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1423    0.1936    2.7162 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9836   -0.8697    1.4532 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5275   -0.3855   -0.1793 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5061   -1.1869   -0.8296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1163   -0.6247   -1.2615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9128   -0.8939    1.0889 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7237   -1.3743    1.6027 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4449   -3.2689   -0.3467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1041   -3.4882    1.3336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3990   -2.8227    0.7649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8526   -4.2312   -0.1963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2801   -2.4763   -2.0483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5288   -3.6813   -1.8376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3640   -2.3851    1.8221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5440   -0.7532    2.1676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4843    0.5481   -1.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2371    0.9321   -0.9554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7373    2.0406    1.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8275    4.2316    0.2593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7177    3.4022   -1.7908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2520    2.6329   -2.3581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1057    4.4172   -2.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0232    4.7188   -0.7417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2045    3.7779    0.7721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4150    2.9623   -0.8268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6272    1.8589    2.0796 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9824    2.5581   -1.0945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4334    1.5375   -1.4072 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9192    2.1697    1.0732 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5227    2.1872   -0.0306 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3837    0.2372   -1.2798 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6686    1.4723   -1.1354 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
  7  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  2  0
 15 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  1  0
 19 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 27 29  1  0
 26 30  1  0
 30 31  1  0
 31 32  2  0
 31 33  1  0
  5 34  1  0
 34 35  1  0
 35  2  1  0
 33  9  1  0
 23 17  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  2 39  1  0
  3 40  1  0
  3 41  1  0
  4 42  1  0
  4 43  1  0
  6 44  1  0
  6 45  1  0
 10 46  1  0
 10 47  1  0
 11 48  1  0
 11 49  1  0
 12 50  1  0
 12 51  1  0
 13 52  1  0
 13 53  1  0
 14 54  1  0
 18 55  1  0
 21 56  1  0
 22 57  1  0
 25 58  1  0
 25 59  1  0
 26 60  1  0
 27 61  1  0
 28 62  1  0
 28 63  1  0
 28 64  1  0
 29 65  1  0
 29 66  1  0
 29 67  1  0
 30 68  1  0
 33 69  1  0
 33 70  1  0
 34 71  1  0
 34 72  1  0
 35 73  1  0
 35 74  1  0
M  END
$$$$
