cxy0236
 OpenBabel09292510182D

 76 82  0  0  1  0  0  0  0  0999 V2000
  379.9500   96.8800    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  294.1800  106.4700    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  324.3000  106.4700    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  364.9000  115.9500    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  301.5500  118.1800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  341.4000  118.2000    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  315.8200  119.3000    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  411.5200  120.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  387.3200  125.1000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
  293.8500  130.5700    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  337.1200  135.0300    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  390.2200  139.3800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  311.4700  139.8200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  297.5300  142.7200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  404.1600  143.3900    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
  321.2900  150.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  293.1800  156.2200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  359.4300  155.8800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  346.2700  156.6700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  373.3700  161.8000    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  407.8400  163.2500    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  316.6000  163.5800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  302.6600  166.9300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  421.3300  168.3800    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  383.3000  172.3900    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
  397.2400  173.1700    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  283.9200  183.7700    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  375.6100  184.8800    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  367.1300  188.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  358.7600  200.6100    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  163.0200  201.2800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  176.6300  203.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  317.7200  204.9600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  330.8800  209.7600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  345.1600  213.4400    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  155.7700  213.4400    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  306.6800  213.7700    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  364.2300  213.4400    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  202.9500  218.2300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  227.9300  218.2300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  280.3500  222.5800    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  164.9100  224.0300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  239.9800  225.4800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  215.4400  225.4800    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  265.6300  225.4800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  287.2700  234.6300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  215.1100  239.7600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  239.9800  239.7600    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  277.7900  245.6700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  227.4900  247.1200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  252.4700  247.1200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  366.0100  101.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  397.3600  111.9400    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  421.3300  110.8200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  380.8500  111.3800    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  414.0900  133.9100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  417.2100  147.6300    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  333.7800  148.4100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  341.4800  170.1600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  326.6400  174.6200    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  365.9000  173.8400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  297.7500  180.3100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  389.1000  186.6700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  381.4000  190.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  186.6600  194.9200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  344.0400  198.2700    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  202.3900  203.8400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  292.4000  208.6400    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  254.8100  215.6700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  177.7400  218.0100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  332.6600  223.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  190.1200  225.3700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  161.7900  238.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  263.9600  239.7600    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  279.8000  259.2800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  108.0000  217.8000    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  1 52  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  1  0  0  0  0
  4 52  1  6  0  0  0
  5  7  2  0  0  0  0
  5 10  1  0  0  0  0
  8 53  1  0  0  0  0
  8 54  2  0  0  0  0
  8 56  1  0  0  0  0
  9 12  1  0  0  0  0
  9 53  1  0  0  0  0
  9 55  1  6  0  0  0
 10 14  1  0  0  0  0
 11 58  1  0  0  0  0
 12 15  1  0  0  0  0
 13 14  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  2  0  0  0  0
 15 21  1  0  0  0  0
 15 56  1  0  0  0  0
 15 57  1  6  0  0  0
 16 22  1  0  0  0  0
 16 58  1  0  0  0  0
 17 23  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 58  1  0  0  0  0
 19 59  2  0  0  0  0
 20 25  1  0  0  0  0
 20 61  1  1  0  0  0
 21 24  1  6  0  0  0
 21 26  1  0  0  0  0
 22 23  2  0  0  0  0
 22 60  1  0  0  0  0
 23 62  1  0  0  0  0
 25 26  1  0  0  0  0
 25 28  1  1  0  0  0
 25 63  1  0  0  0  0
 26 63  1  1  0  0  0
 27 62  1  0  0  0  0
 29 30  1  0  0  0  0
 29 61  1  0  0  0  0
 29 64  2  0  0  0  0
 30 38  1  0  0  0  0
 31 32  1  0  0  0  0
 31 36  1  0  0  0  0
 32 65  2  0  0  0  0
 32 70  1  0  0  0  0
 33 34  1  0  0  0  0
 33 37  1  0  0  0  0
 34 66  1  0  0  0  0
 34 71  2  0  0  0  0
 35 66  1  0  0  0  0
 36 42  1  0  0  0  0
 37 68  1  0  0  0  0
 39 44  1  0  0  0  0
 39 67  2  0  0  0  0
 39 72  1  0  0  0  0
 40 43  1  0  0  0  0
 40 44  1  0  0  0  0
 41 45  1  0  0  0  0
 41 46  1  0  0  0  0
 41 68  1  0  0  0  0
 42 70  1  0  0  0  0
 42 73  2  0  0  0  0
 43 48  1  0  0  0  0
 44 47  1  0  0  0  0
 45 69  2  0  0  0  0
 45 74  1  0  0  0  0
 46 49  1  0  0  0  0
 47 50  1  0  0  0  0
 48 50  1  0  0  0  0
 48 51  1  0  0  0  0
 49 74  1  0  0  0  0
 49 75  2  0  0  0  0
 51 74  1  0  0  0  0
 66 30  1  0  0  0  0
 70 72  1  0  0  0  0
 76 36  1  0  0  0  0
M  END
>  <Formula>
C52HClN5O16S

$$$$
