YMQPAY0081
 OpenBabel09292510482D

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  386.2000  253.6300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  363.4600  261.5300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  381.7300  240.3400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  358.2900  248.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  335.1900  257.0200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  300.1100  269.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  367.6000  237.3000    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  344.0600  246.2300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  321.4300  255.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  414.4500  218.6400    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  289.6800  259.0800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
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  315.9400  241.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  413.6000  203.9000    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  290.6800  245.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  295.7600  282.8600    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  402.0600  239.1900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  314.7300  267.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  391.3200  229.6000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  400.9100  218.8600    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  380.5800  220.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  265.7400  245.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  418.8900  179.5300    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  278.2100  223.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  240.8000  202.1000    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  2  4  2  0  0  0  0
  3  5  1  0  0  0  0
  4  8  1  0  0  0  0
  4 31  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 12  1  0  0  0  0
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  7 30  2  0  0  0  0
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 10 30  1  0  0  0  0
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 27 37  1  0  0  0  0
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M  END
>  <Formula>
C27N5O4S

$$$$
