D00416
  -OEChem-05072121543D

 31 32  0     1  0  0  0  0  0999 V2000
    4.7823    2.3563   -0.5199 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8503    2.7701    0.1946 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3934   -1.8015   -0.3693 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7873   -0.3135   -0.0492 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9374   -2.9282    0.4208 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6477   -1.9361   -1.7907 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5377    0.8435   -0.5285 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8404   -1.5790   -0.7733 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7675   -1.0677    0.4016 N   0  0  1  0  0  0  0  0  0  0  0  0
    1.9816    1.2197   -0.0773 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2639   -0.6043    1.5771 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0792    0.2734   -0.2103 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.2114   -0.4968   -0.2111 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6482    0.8352   -0.1131 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3599    0.8757    0.3588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1421   -0.8430   -0.1899 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7598   -1.0709    1.8950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3441    1.8200    0.0175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1000    0.1585   -0.0684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7026    1.4887    0.0353 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2522    0.0968   -1.2810 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1923    2.2108   -0.1205 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1992    0.1785    0.2719 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2516    1.1572    1.4107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4300   -1.8874   -0.2644 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1189   -0.2825    2.2976 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7787   -0.9380    2.2701 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4201   -2.0383    2.2752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0456    2.8639    0.1100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4421   -1.5787    1.8494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9033    0.0734    2.0097 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  2 20  1  0  0  0  0
  3  5  2  0  0  0  0
  3  6  2  0  0  0  0
  3  9  1  0  0  0  0
  3 13  1  0  0  0  0
  4  7  2  0  0  0  0
  4  8  2  0  0  0  0
  4 11  1  0  0  0  0
  4 19  1  0  0  0  0
  9 12  1  0  0  0  0
  9 17  1  0  0  0  0
 10 12  1  0  0  0  0
 10 14  1  0  0  0  0
 10 22  1  0  0  0  0
 11 30  1  0  0  0  0
 11 31  1  0  0  0  0
 12 15  1  0  0  0  0
 12 21  1  0  0  0  0
 13 14  1  0  0  0  0
 13 16  2  0  0  0  0
 14 18  2  0  0  0  0
 15 23  1  0  0  0  0
 15 24  1  0  0  0  0
 16 19  1  0  0  0  0
 16 25  1  0  0  0  0
 17 26  1  0  0  0  0
 17 27  1  0  0  0  0
 17 28  1  0  0  0  0
 18 20  1  0  0  0  0
 18 29  1  0  0  0  0
 19 20  2  0  0  0  0
M  END

$$$$