TJL0155
 OpenBabel09292510182D

134  4  0  0  0  0  0  0  0  0999 V2000
 1233.6800  167.3300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1258.1600  166.9800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1209.3200  168.0200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1012.4600  168.3600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1086.2400  168.3600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1160.3600  168.7100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1184.8400  168.0200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  782.6200  172.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  856.4000  172.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  905.0100  172.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  929.3700  172.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  831.9200  172.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  978.6700  172.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  757.8000  173.4200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1270.8000  173.7600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1221.5000  174.5700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1245.9800  174.1100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1172.5500  175.2600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1148.0700  175.9500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1067.1600  178.8200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1104.2800  178.8200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  794.2300  179.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  819.3900  179.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  868.5800  179.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  892.7100  179.5100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  940.9800  179.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  966.1500  179.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1030.5000  179.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  748.1400  184.2200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1148.5300  189.9700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  768.9400  193.5300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  819.3900  193.5300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  754.9200  196.4000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  831.5800  200.7700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  831.5800  214.7900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1185.8800  214.7900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1210.7000  214.4400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1161.4000  215.1300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  899.6100  217.6600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1223.0000  221.2300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1174.0400  222.0300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1198.5200  221.6800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  899.9500  232.0300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  875.4800  232.0300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  950.6300  235.3600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  863.2900  238.9200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  911.7900  238.9200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  936.9600  240.6500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  975.4600  241.8000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  961.4400  244.3200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  863.2900  255.1300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  982.3500  254.3200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  935.2300  254.7800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  959.6000  258.3400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1129.4500  259.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1154.2700  259.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1202.7700  259.0300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1240.2300  260.5300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  946.3800  263.7500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1141.6300  266.6200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1166.1100  266.6200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1190.2400  266.2700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1215.0700  266.2700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1245.9800  273.4000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1260.0000  275.5800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1108.1900  278.8000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  972.9300  280.2900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1190.5900  280.9800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1215.4100  280.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1027.9800  282.0200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1042.3400  282.0200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  998.4400  284.2000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  984.7700  288.5700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1202.7700  287.7600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1225.8700  289.2600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1262.5300  289.2600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1114.2800  291.7900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1020.7300  294.6600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1049.2400  294.3100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1007.1700  295.0000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1091.6400  294.6600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1275.8600  295.0000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1249.8900  296.0400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1077.9700  300.7500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  999.5900  306.5000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1027.9800  306.5000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1042.6900  306.5000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  973.6200  311.5500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1106.0100  315.4600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 1260.5800  152.9600    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1183.9200  153.6500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1236.1000  153.6500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  831.4600  157.2100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  904.2100  157.4400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  977.6400  157.4400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  754.4600  159.0500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  806.7500  167.6700    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  879.8400  167.6700    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  953.3900  167.6700    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1049.2400  166.7500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1285.7400  166.9800    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1125.3100  169.9700    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1196.6800  179.1600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  993.6100  182.8400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  769.7500  179.0500    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  843.4100  183.3000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  916.9600  183.3000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  733.2000  183.6500    0.0000 S   0  0  0  0  0 15  0  0  0  0  0  0
 1249.4300  189.2800    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1224.6000  189.3900    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1103.8200  192.8400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  794.2300  193.4100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  867.5500  193.4100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  941.4400  193.1800    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1135.3100  197.3200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1213.0000  200.0800    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1164.2700  201.0000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1188.6300  200.7700    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  778.9400  202.7200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1238.3900  213.7500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  874.7900  216.9700    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  818.8200  221.4500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  926.1600  227.5500    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  846.5100  231.6800    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1201.5000  236.1600    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1176.6800  236.3900    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  886.9700  242.8300    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1128.5300  244.3200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1225.6400  253.5200    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1249.5400  250.4100    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
 1238.9800  240.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 1260.1000  260.1300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 1259.2600  239.8600    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
 1239.8200  260.9700    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
130131  2  0  0  0  0
130132  2  0  0  0  0
130133  1  0  0  0  0
134130  1  0  0  0  0
M  CHG  1 133  -1
M  END
>  <Formula>
C90N14O28S2-

$$$$
TJL0155
 OpenBabel09292510183D

 19  1  0  0  0  0  0  0  0  0999 V2000
 1239.8200  260.9700    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
  911.2200  252.9400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1177.4900  258.9200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1255.5200  262.8300    0.0000 H   0  0  0  0  0 15  0  0  0  0  0  0
  971.8900  264.2100    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1110.1400  266.0400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1093.8200  280.4100    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1239.6600  285.8100    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  959.4800  286.0400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1063.2600  290.5200    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1170.5900  287.7600    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
 1103.7100  301.0900    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  984.6500  302.2400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
 1222.1900  303.5100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1077.0500  314.6500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
 1167.1300  305.7200    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  703.8000  184.1500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  850.8200  262.3300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  875.7600  262.3300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 11 16  1  0  0  0  0
M  END
>  <Formula>
C4N7O6

$$$$
