cxy0564
 OpenBabel09292510182D

 95 98  0  0  1  0  0  0  0  0999 V2000
  758.8600  184.6300    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  734.0400  184.6300    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  807.6200  184.6300    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  832.3300  184.9600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  884.4900  189.0200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  746.1200  191.5500    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  820.0300  191.5500    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  844.7300  191.5500    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  870.6500  191.5500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  890.9700  201.7600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  746.4500  205.7100    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  574.5900  205.7100    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  599.7400  205.7100    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  672.8800  205.7100    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  697.6900  205.7100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  721.7400  205.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  795.6500  205.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  820.0300  206.1500    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  844.4000  205.7100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  881.8500  211.5400    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  586.6700  212.6300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  660.9100  212.6300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  685.2800  213.0700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  758.4200  212.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  783.2400  212.6300    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  832.0000  213.0700    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  856.0400  212.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  908.1000  220.6500    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  884.8200  225.3700    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  587.3300  226.9100    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  636.0900  227.2400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  660.9100  227.2400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  685.2800  227.2400    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  783.2400  227.2400    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  535.6100  228.0100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  560.7600  228.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  734.4800  227.5700    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  807.2900  227.5700    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  898.3200  229.7700    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  599.7400  233.8300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  949.6100  233.3900    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  624.1200  234.1600    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  672.8800  234.1600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  770.5000  234.4900    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  795.6500  234.1600    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  819.5900  234.4900    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  472.6800  235.2600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  498.9300  234.9300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  523.3100  234.9300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  548.0200  234.9300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  963.1100  238.2200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  938.3000  243.2700    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  901.1800  243.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  623.7900  248.3200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  877.1300  248.7600    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  498.9300  249.4200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  472.6800  250.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  965.6400  251.9500    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  636.0900  255.6800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  941.5900  257.4400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  460.6000  257.4400    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  917.5400  262.1600    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  955.4300  261.8300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  931.0500  266.5500    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  635.7600  269.8500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  907.0000  272.0400    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  648.5000  291.3700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  721.1900  191.2200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  794.8800  191.3300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  770.1700  201.7600    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  868.4500  205.9300    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  635.4300  212.8500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  709.0000  213.0700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  733.3800  212.8500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  807.2900  212.8500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  559.3300  213.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  611.1600  223.0700    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  485.0900  227.0200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  757.8700  226.9100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  510.1300  227.5700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  831.6700  227.2400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  855.8200  227.0200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  574.2600  238.2200    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  647.9500  238.2200    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  873.7300  234.4900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  917.7600  248.2100    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  598.6400  248.3200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  447.2100  249.8600    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  889.8700  253.2700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  485.0900  257.8800    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  651.4600  276.9800    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  937.0900  280.6100    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  635.4300  298.2900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  665.9600  299.2800    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  407.8500  254.1000    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  6  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7  3  1  6  0  0  0
  7  4  1  0  0  0  0
  7 18  1  0  0  0  0
  9 71  1  0  0  0  0
 11 24  1  0  0  0  0
 11 74  1  0  0  0  0
 12 21  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  2  0  0  0  0
 14 23  1  0  0  0  0
 15 23  1  0  0  0  0
 15 73  1  0  0  0  0
 16 68  2  0  0  0  0
 16 73  1  0  0  0  0
 16 74  1  0  0  0  0
 17 69  2  0  0  0  0
 17 75  1  0  0  0  0
 18 26  1  0  0  0  0
 19 27  1  0  0  0  0
 20 10  1  0  0  0  0
 20 29  1  6  0  0  0
 20 71  1  0  0  0  0
 22 32  1  0  0  0  0
 23 33  2  0  0  0  0
 24 70  1  0  0  0  0
 24 79  2  0  0  0  0
 25 17  1  1  0  0  0
 25 34  1  0  0  0  0
 25 70  1  0  0  0  0
 26 19  1  6  0  0  0
 26 81  1  0  0  0  0
 27 71  1  0  0  0  0
 27 82  2  0  0  0  0
 29 39  1  0  0  0  0
 29 85  1  6  0  0  0
 30 21  1  6  0  0  0
 30 40  1  0  0  0  0
 30 83  1  0  0  0  0
 31 42  1  0  0  0  0
 31 72  2  0  0  0  0
 31 84  1  0  0  0  0
 32 43  2  0  0  0  0
 32 84  1  0  0  0  0
 33 43  1  0  0  0  0
 34 44  1  0  0  0  0
 34 45  1  0  0  0  0
 35 49  1  0  0  0  0
 35 50  1  0  0  0  0
 36 50  1  0  0  0  0
 36 76  2  0  0  0  0
 36 83  1  0  0  0  0
 37 74  1  0  0  0  0
 38 75  1  0  0  0  0
 39 28  1  6  0  0  0
 39 53  1  0  0  0  0
 40 77  1  0  0  0  0
 40 87  2  0  0  0  0
 41 51  1  0  0  0  0
 41 52  2  0  0  0  0
 42 54  1  1  0  0  0
 42 77  1  0  0  0  0
 46 81  1  0  0  0  0
 47 57  2  0  0  0  0
 47 78  1  0  0  0  0
 48 56  1  0  0  0  0
 48 78  2  0  0  0  0
 48 80  1  0  0  0  0
 49 80  1  0  0  0  0
 51 58  2  0  0  0  0
 52 60  1  0  0  0  0
 53 86  1  0  0  0  0
 53 89  2  0  0  0  0
 54 59  1  0  0  0  0
 55 85  1  0  0  0  0
 56 90  2  0  0  0  0
 57 61  1  0  0  0  0
 57 90  1  0  0  0  0
 58 63  1  0  0  0  0
 59 65  1  0  0  0  0
 60 63  2  0  0  0  0
 60 64  1  0  0  0  0
 61 88  1  0  0  0  0
 62 64  1  0  0  0  0
 62 66  1  6  0  0  0
 62 86  1  0  0  0  0
 64 92  1  1  0  0  0
 65 91  1  0  0  0  0
 67 91  1  0  0  0  0
 67 93  2  0  0  0  0
 67 94  1  0  0  0  0
 75 18  1  0  0  0  0
 95 88  1  0  0  0  0
M  END
>  <Formula>
C68N12O14S

$$$$
