BE53SW
  -OEChem-04022107053D

 20 20  0     0  0  0  0  0  0999 V2000
    1.3145    0.9551   -0.3495 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4957    2.3908   -0.5015 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7865    0.0487   -1.3856 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2774    0.0166    0.9015 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2002   -2.2992   -1.2343 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5058   -2.2550    0.9391 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9513    0.4788    1.1741 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0150   -1.7982   -0.1056 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.3892    0.6297   -0.1029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8794   -0.6727   -0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2626    1.7128   -0.0022 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2429   -0.8920    0.1894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6260    1.4935    0.1943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1162    0.1912    0.2901 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9142    2.7390   -0.0701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6404   -1.9012    0.2662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3063    2.3365    0.2734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1777    0.0206    0.4433 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9951    1.2154    1.8909 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5668   -0.3487    1.7546 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  7  1  0  0  0  0
  1  9  1  0  0  0  0
  4  7  1  0  0  0  0
  4 20  1  0  0  0  0
  5  8  1  0  0  0  0
  6  8  2  0  0  0  0
  7 19  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 11 15  1  0  0  0  0
 12 14  1  0  0  0  0
 12 16  1  0  0  0  0
 13 14  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
M  CHG  2   5  -1   8   1
M  END

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