
     RDKit          3D

 72 74  0  0  0  0  0  0  0  0999 V2000
    5.2232    4.4293   -0.3022 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2589    3.3830   -0.8767 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6924    3.8789   -2.2158 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1465    3.0762    0.1573 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0954    2.0241   -0.2765 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7157    0.6465   -0.5597 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3062    0.1200    0.6270 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5561   -1.2280    0.9561 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9349   -1.4619    2.2862 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1810   -2.7525    2.7523 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0682   -3.8393    1.8888 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3905   -5.4616    2.4725 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.7117   -3.6345    0.5557 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4408   -2.3423    0.0699 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1490   -2.2172   -1.3706 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9780   -1.6169   -2.1054 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9772   -2.7981   -1.9715 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0684   -3.7374   -1.3016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3827   -3.5473   -1.7911 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1988   -2.5439   -0.9534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4663   -1.2084   -0.7505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3536   -0.1270   -0.2998 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3407   -0.3737    0.7203 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0523   -1.1079    1.7051 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6940    0.2773    0.6497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8132   -0.7242    0.9564 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1613   -0.0790    0.7789 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7400    0.6530    1.8290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9756    1.2834    1.6507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6364    1.1953    0.4224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0609    0.4797   -0.6311 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8252   -0.1520   -0.4571 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9877    1.2623   -0.6211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3355    1.9185    0.5687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0745    2.4129    1.4621 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0859    1.8955    0.7831 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6624    4.0652    0.6511 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6936    5.3875   -0.1104 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0571    4.6164   -1.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8553    2.4650   -1.0634 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9963    4.7302   -2.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1575    3.0604   -2.7400 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5155    4.2109   -2.8844 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6096    4.0222    0.3932 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247    2.7336    1.1020 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6060    2.3930   -1.2006 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9106   -0.0097   -0.9139 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4739    0.7190   -1.3628 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0267   -0.6286    2.9716 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4639   -2.9052    3.7861 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6573   -4.4881   -0.1098 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8782   -2.6870   -3.0069 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1071   -3.6270   -0.1976 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3979   -4.7701   -1.5455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9028   -4.5286   -1.7402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3950   -3.2378   -2.8590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4197   -3.0014    0.0352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1667   -2.3605   -1.4702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0097   -0.9257   -1.7232 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3335   -1.3463    0.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8545    0.6862   -0.3710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7277    1.1173    1.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7238   -1.6042    0.2813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7127   -1.0954    2.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2326    0.7385    2.7816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4180    1.8450    2.4631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5910    1.6867    0.2851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5699    0.4189   -1.5845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3853   -0.6946   -1.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3193    1.2977   -1.5040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8938    1.8359   -0.9081 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4144    1.8978    1.7760 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  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 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  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  2  0
 22 33  1  0
 33 34  1  0
 34 35  2  0
 34 36  1  0
 36  5  1  0
 14  8  1  0
 32 27  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  2 40  1  0
  3 41  1  0
  3 42  1  0
  3 43  1  0
  4 44  1  0
  4 45  1  0
  5 46  1  0
  6 47  1  0
  6 48  1  0
  9 49  1  0
 10 50  1  0
 13 51  1  0
 17 52  1  0
 18 53  1  0
 18 54  1  0
 19 55  1  0
 19 56  1  0
 20 57  1  0
 20 58  1  0
 21 59  1  0
 21 60  1  0
 25 61  1  0
 25 62  1  0
 26 63  1  0
 26 64  1  0
 28 65  1  0
 29 66  1  0
 30 67  1  0
 31 68  1  0
 32 69  1  0
 33 70  1  0
 33 71  1  0
 36 72  1  0
M  END
$$$$
