BL2FP4
  -OEChem-04022102303D

 31 32  0     0  0  0  0  0  0999 V2000
    1.3154   -1.2179    2.6517 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0545    0.7835   -1.3763 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5444   -2.0414   -0.0131 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6722   -1.2943   -1.9252 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.5072   -1.8049    0.0399 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1550   -0.5674    0.1733 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8711   -1.0331   -0.7155 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.9012   -0.3219   -1.2396 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5541   -0.5631    0.5774 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6655    0.9117   -1.6997 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2488    0.6800    0.0386 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1596   -0.8811    1.0371 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2039   -0.9557    0.4381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0798    0.2396    0.3763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3569    0.1814   -0.1814 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5987    1.4425    0.8933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1531    1.3259   -0.2222 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3948    2.5872    0.8525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6721    2.5290    0.2948 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8492   -0.2070   -1.5007 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2748   -1.2052   -1.7722 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0037   -1.4591    0.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7082   -0.6178    1.6561 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5831    1.0233   -2.7852 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2698    1.8235   -1.2365 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8720    1.5897    0.5213 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3255    0.6216    0.2260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3914    1.5405    1.3265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1506    1.2962   -0.6539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0197    3.5248    1.2523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2916    3.4204    0.2625 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  2  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  3 13  2  0  0  0  0
  4  7  1  0  0  0  0
  5  7  2  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 12  1  0  0  0  0
  7 15  1  0  0  0  0
  8 10  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  9 11  1  0  0  0  0
  9 22  1  0  0  0  0
  9 23  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
 11 26  1  0  0  0  0
 11 27  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 16 28  1  0  0  0  0
 17 19  1  0  0  0  0
 17 29  1  0  0  0  0
 18 19  2  0  0  0  0
 18 30  1  0  0  0  0
 19 31  1  0  0  0  0
M  CHG  2   4  -1   7   1
M  END

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