B71LJO
  -OEChem-04022102593D

 52 55  0     0  0  0  0  0  0999 V2000
    8.8205    1.0941   -1.8616 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.5363    0.2734   -1.7263 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.3085   -3.0231   -0.8585 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1062   -1.7779    1.4396 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6882   -1.2857   -0.1677 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3133   -0.1307    0.2261 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1944   -0.9242   -0.5424 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8494    1.7104   -1.2680 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8601    0.0978    0.2814 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9063   -2.0800   -0.3050 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1743    0.3178    1.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1009   -1.2261   -0.7243 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4540   -1.8612   -0.4716 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5738    0.4408    0.3821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7555   -0.9754   -0.2985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0131   -1.7355   -0.6646 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4627    0.4756   -0.6923 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9464    0.9804    1.6133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1963   -0.0211    0.2827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1282   -1.0123    0.4885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0156    0.7396   -0.8603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2973    0.2012    1.0880 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7241    1.0502   -0.5357 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2079    1.5546    1.7700 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0967    1.5897    0.6955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1880    1.1992    0.7019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9235    1.9147   -0.4663 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5612   -0.5735    2.3317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8725    2.9871   -0.8889 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8282    0.7247   -0.6181 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0273    0.3986    0.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7498   -2.8877   -1.0279 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0922   -2.5463    0.6704 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2505    1.3873    1.2623 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1607   -0.2352    1.9782 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9812   -1.8786   -0.7726 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9265   -0.8100   -1.7241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6341   -0.0873   -0.9279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8248   -0.6554    0.7468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9638   -2.1182   -1.6920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1251   -2.6076   -0.0083 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1845    0.0741   -1.6637 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2853    0.9556    2.4752 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4997    1.9714    2.7296 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0766    2.0399    0.8325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0716    1.4211    1.2931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6782   -1.6381    2.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7463   -0.4380    3.0501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4831   -0.2467    2.8255 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9385    3.7620   -0.1186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5409    3.4622   -1.8180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8686    2.5674   -1.0613 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 23  1  0  0  0  0
  2  7  1  0  0  0  0
  2 21  1  0  0  0  0
  3 13  2  0  0  0  0
  4 20  2  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 13  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  6 14  1  0  0  0  0
  7 16  1  0  0  0  0
  7 20  1  0  0  0  0
  8 21  1  0  0  0  0
  8 27  2  0  0  0  0
  9 11  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10 12  1  0  0  0  0
 10 32  1  0  0  0  0
 10 33  1  0  0  0  0
 11 34  1  0  0  0  0
 11 35  1  0  0  0  0
 12 36  1  0  0  0  0
 12 37  1  0  0  0  0
 13 15  1  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 16  1  0  0  0  0
 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 16 41  1  0  0  0  0
 17 23  1  0  0  0  0
 17 42  1  0  0  0  0
 18 24  2  0  0  0  0
 18 43  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
 19 22  1  0  0  0  0
 22 26  2  0  0  0  0
 22 28  1  0  0  0  0
 23 25  2  0  0  0  0
 24 25  1  0  0  0  0
 24 44  1  0  0  0  0
 25 45  1  0  0  0  0
 26 27  1  0  0  0  0
 26 46  1  0  0  0  0
 27 29  1  0  0  0  0
 28 47  1  0  0  0  0
 28 48  1  0  0  0  0
 28 49  1  0  0  0  0
 29 50  1  0  0  0  0
 29 51  1  0  0  0  0
 29 52  1  0  0  0  0
M  END

$$$$