cxylin0435
 OpenBabel09292510402D

113  4  0  0  0  0  0  0  0  0999 V2000
  309.8500  288.6000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  297.5800  310.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  298.0200  324.4200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  430.4700  329.3900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  236.3300  331.4900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  285.0800  331.4900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  451.7000  340.8900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  409.4600  341.8900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  437.4400  341.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   56.4400  343.9900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   31.3400  344.3200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  236.3300  345.7600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  285.4200  345.7600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  261.4200  345.7600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  334.6200  345.7600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   43.5100  350.9500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   68.6000  351.2800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  224.0500  352.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  248.4900  352.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  297.2400  352.3900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  321.6800  352.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  346.7800  352.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  416.8700  354.0500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  431.4700  353.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  472.9300  355.8200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  452.3600  365.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   43.5100  365.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   68.6000  365.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  438.1000  366.3200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  321.3500  367.3200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  346.7800  366.9800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  417.2000  368.0900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  474.7000  369.4200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  499.4600  371.5200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   56.1100  372.6200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  236.6600  373.2900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  334.1700  373.9500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  358.6100  374.2800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  383.3700  373.6200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  462.0900  375.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  404.9300  375.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  486.5300  377.0500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  510.9600  379.5900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   31.6800  387.8800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   56.4400  387.8800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   81.5400  388.2100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  131.7300  387.8800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  236.6600  387.8800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  106.9700  388.2100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  485.0900  391.4200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  223.0600  394.5100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   43.5100  394.8500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   68.6000  394.8500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   94.0300  395.1800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  118.8000  394.8500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  143.9000  395.1800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  471.9300  397.2800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  496.5900  398.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  198.9600  408.1100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  223.7200  408.7800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  272.5900  409.1100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  349.5400  409.8800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   43.5100  409.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   68.6000  409.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   94.4700  409.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  118.8000  410.2100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  143.9000  409.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  299.3500  409.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  471.1600  411.2100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  495.5900  412.9800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  185.8000  415.4100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  235.5500  415.4100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   56.1100  416.5200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  260.3200  416.1800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  311.9500  415.7400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  335.9400  416.1800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  155.3900  416.5200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  131.4000  417.1800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  483.1000  419.6100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  186.1300  429.6700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  260.3200  430.4500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  198.2900  436.7500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  272.5900  437.7400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  198.6200  451.0100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  272.1500  452.0100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  348.2100  451.6700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  298.3500  452.0100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  311.1800  458.3100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  335.2800  458.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  185.8000  472.5700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  210.4500  472.5700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  222.7300  478.8700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  198.6200  479.2000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  297.1300  281.7400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  327.9800  283.1800    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  312.8300  303.1900    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  458.0000  328.2900    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  415.6600  329.3900    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  260.5400  330.9400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  309.3000  341.7800    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  394.3200  342.4400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  458.6700  352.1700    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  272.3700  356.7000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  398.1900  365.2200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  223.0600  366.4300    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  251.4700  366.9800    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  296.8000  366.6500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  370.3300  366.7600    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
   86.9600  373.2900    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   81.3800  386.5100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   92.5300  360.0600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   73.7300  367.7100    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  100.1800  378.8600    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
109110  2  0  0  0  0
109111  2  0  0  0  0
112109  1  0  0  0  0
113109  1  0  0  0  0
M  END
>  <Formula>
C95N6O11S

$$$$
cxylin0435
 OpenBabel09292510402D

 10  1  0  0  0  0  0  0  0  0999 V2000
  100.1800  378.8600    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
  105.9700  373.8400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  382.3800  387.7700    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  460.4300  389.3200    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  198.8400  392.4100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  272.3700  395.0700    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  173.2000  403.9100    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  247.8200  405.4600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  375.3000  409.3300    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  362.1800  415.1400    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
 10  9  1  0  0  0  0
M  END
>  <Formula>
C2N3O4

$$$$
cxylin0435
 OpenBabel09292510402D

 10  4  0  0  0  0  0  0  0  0999 V2000
  362.1800  415.1400    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
  323.2300  409.1100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  211.0100  419.0600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  286.5200  420.1600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  359.8200  416.1800    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
   81.3000  418.3100    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   73.1500  430.1200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   89.4500  406.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   69.4900  410.1600    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
   93.1100  426.4600    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  6  7  2  0  0  0  0
  6  8  2  0  0  0  0
  9  6  1  0  0  0  0
 10  6  1  0  0  0  0
M  END
>  <Formula>
C2N2O4S

$$$$
cxylin0435
 OpenBabel09292510402D

  6  1  0  0  0  0  0  0  0  0999 V2000
   93.1100  426.4600    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
  510.9600  421.4900    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  235.1100  430.2300    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  155.2800  431.3300    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  374.3100  451.3400    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  361.4200  457.6500    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  6  5  1  0  0  0  0
M  END
>  <Formula>
C2O3

$$$$
cxylin0435
 OpenBabel09292510403D

 28 20  0  0  1  0  0  0  0  0999 V2000
  361.4200  457.6500    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
  322.5600  451.9000    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  185.3600  457.6500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  213.4400  457.7600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  285.4200  462.6200    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  258.7700  458.8600    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  358.9400  458.8600    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  234.6700  471.9100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  275.8800  499.4600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  250.4900  499.7900    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  300.6000  499.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  238.9200  506.2500    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  263.1900  506.2500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  238.9200  520.6100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  250.9400  541.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  263.5200  548.7900    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  239.2500  548.7900    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  238.9200  563.4800    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  263.5200  563.4800    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  250.4900  570.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  250.9400  584.7500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  299.9300  484.3100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  221.8800  499.4600    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  287.3500  510.2600    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  318.4200  507.2500    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  225.5500  527.5200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  254.1700  527.2900    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  262.7400  591.2100    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  9 13  1  0  0  0  0
  9 24  1  0  0  0  0
 10 13  1  0  0  0  0
 11 22  2  0  0  0  0
 11 24  1  0  0  0  0
 11 25  1  0  0  0  0
 12 10  1  0  0  0  0
 12 14  1  0  0  0  0
 12 23  1  6  0  0  0
 14 26  2  0  0  0  0
 14 27  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 15 27  1  0  0  0  0
 16 19  2  0  0  0  0
 17 18  1  0  0  0  0
 18 20  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 28  1  0  0  0  0
M  END
>  <Formula>
C13N6O8

$$$$
