
     RDKit          3D

 55 58  0  0  0  0  0  0  0  0999 V2000
    1.6698    4.5720   -2.6626 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7057    3.8021   -1.8662 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0861    2.6063   -1.3231 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1874    1.8263   -0.5738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1247    2.3128   -0.3799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5032    3.5139   -0.9791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5792    4.2520   -1.7196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9452    5.3367   -2.2501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0898    1.6285    0.3654 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9442    1.2899    1.7430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2043    0.5671    2.2426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6979   -0.5346    1.2861 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7538   -1.7497    1.2248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7597   -2.3724   -0.1529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5751   -3.4920   -0.3939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6721   -4.0377   -1.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6899   -5.4381   -1.9607 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.9712   -3.4590   -2.7377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1688   -2.3383   -2.5170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0459   -1.7938   -1.2335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2334   -0.6654   -1.0657 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0393   -0.6861   -0.3349 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4672   -1.8723    0.1058 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6149   -1.9491    0.8260 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3225   -0.7857    1.1459 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6135   -0.8608    1.9111 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9934   -1.0057    0.7891 S   0  0  0  0  0  6  0  0  0  0  0  0
    6.5039   -1.0935    1.7234 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0398    0.1919   -0.1179 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8477   -2.2525   -0.0374 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8383    0.4446    0.6858 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6496    0.5123   -0.0585 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7095    4.2082   -2.5122 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6466    5.6423   -2.3648 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4161    4.4860   -3.7404 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0924    2.2360   -1.4873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5158    3.8797   -0.8564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8016    2.2191    2.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0557    0.6521    1.9081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0109    0.1352    3.2486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0163    1.3185    2.3520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6953   -0.8827    1.6328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8598   -0.0980    0.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7218   -1.4824    1.5112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0759   -2.4932    1.9869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1451   -3.9352    0.4136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0509   -3.8740   -3.7344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6324   -1.8935   -3.3456 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9754   -2.9178    1.1471 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6082   -1.7367    2.5947 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7457    0.0501    2.5333 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3653   -1.1837    1.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4754   -1.9779    2.3928 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6168   -0.1737    2.3336 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3880    1.3518    0.9090 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  5  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  2  0
 15 16  1  0
 16 17  1  0
 16 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 27 30  2  0
 25 31  1  0
 31 32  2  0
  7  2  1  0
 20 14  1  0
 32 22  1  0
 32  4  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  3 36  1  0
  6 37  1  0
 10 38  1  0
 10 39  1  0
 11 40  1  0
 11 41  1  0
 12 42  1  0
 12 43  1  0
 13 44  1  0
 13 45  1  0
 15 46  1  0
 18 47  1  0
 19 48  1  0
 24 49  1  0
 26 50  1  0
 26 51  1  0
 28 52  1  0
 28 53  1  0
 28 54  1  0
 31 55  1  0
M  END
$$$$
