P8J
  CCTOOLS-0919241031

 57 59  0  0  1  0  0  0  0  0999 V2000
   -0.9860    0.1850   -0.4490 C   0  0  0  0  0
    1.1750   -0.1170   -1.7850 C   0  0  0  0  0
   -5.8310   -2.2370    1.5230 C   0  0  0  0  0
   -5.1890   -0.8600    1.3400 C   0  0  0  0  0
   -3.4100    0.2700    0.1960 C   0  0  0  0  0
   -4.3790    1.2940   -0.4000 C   0  0  0  0  0
    5.8680    2.3120    1.3160 C   0  0  0  0  0
    5.3170    1.3100    0.2990 C   0  0  0  0  0
    5.3370   -1.0170   -0.2790 C   0  0  0  0  0
    3.2430    0.2910   -0.6430 C   0  0  0  0  0
    7.2950   -2.3620    0.0400 C   0  0  0  0  0
    5.8710   -2.2800    0.1240 O   0  0  0  0  0
    3.8070   -1.0830   -0.2680 C   0  0  0  0  0
    3.3650   -2.0560   -1.2160 O   0  0  0  0  0
    5.7750   -0.0030    0.6270 O   0  0  0  0  0
    7.2920    2.3710    1.2030 O   0  0  0  0  0
    3.7870    1.3380    0.3330 C   0  0  0  0  0
    3.3330    1.0400    1.6550 O   0  0  0  0  0
    1.8160    0.2590   -0.5640 O   0  0  0  0  0
   -0.3190   -0.1170   -1.5880 C   0  0  0  0  0
   -1.2470   -0.4170   -2.5030 N   0  0  0  0  0
   -2.4110   -0.3070   -1.9680 N   0  0  0  0  0
   -2.3010    0.0470   -0.7350 N   0  0  0  0  0
   -4.0990   -0.9610    0.4210 O   0  0  0  0  0
   -4.8950   -3.1200    2.1440 O   0  0  0  0  0
   -6.2300    0.1190    0.7890 C   0  0  0  0  0
   -6.7500   -0.3810   -0.4440 O   0  0  0  0  0
   -5.5650    1.4780    0.5510 C   0  0  0  0  0
   -6.5110    2.3770   -0.0310 O   0  0  0  0  0
   -3.7070    2.5440   -0.5720 O   0  0  0  0  0
   -0.5550    0.4740    0.4980 H   0  0  0  0  0
    1.4380    0.5950   -2.5680 H   0  0  0  0  0
    1.5030   -1.1150   -2.0760 H   0  0  0  0  0
   -6.7160   -2.1440    2.1530 H   0  0  0  0  0
   -6.1180   -2.6370    0.5510 H   0  0  0  0  0
   -4.8230   -0.4990    2.3000 H   0  0  0  0  0
   -3.0200    0.6460    1.1420 H   0  0  0  0  0
   -4.7380    0.9370   -1.3650 H   0  0  0  0  0
    5.4470    3.2980    1.1200 H   0  0  0  0  0
    5.5960    1.9950    2.3220 H   0  0  0  0  0
    5.6630    1.5780   -0.6990 H   0  0  0  0  0
    5.6840   -0.7800   -1.2850 H   0  0  0  0  0
    3.5460    0.5450   -1.6590 H   0  0  0  0  0
    7.6220   -3.3510    0.3630 H   0  0  0  0  0
    7.6090   -2.1950   -0.9900 H   0  0  0  0  0
    7.7410   -1.6040    0.6830 H   0  0  0  0  0
    3.4620   -1.3600    0.7270 H   0  0  0  0  0
    3.6890   -2.9500   -1.0430 H   0  0  0  0  0
    7.7100    2.9870    1.8190 H   0  0  0  0  0
    3.4340    2.3280    0.0410 H   0  0  0  0  0
    3.6440    1.6610    2.3270 H   0  0  0  0  0
   -5.2350   -4.0130    2.2920 H   0  0  0  0  0
   -7.0410    0.2310    1.5090 H   0  0  0  0  0
   -7.4160    0.1900   -0.8510 H   0  0  0  0  0
   -5.2120    1.8820    1.5000 H   0  0  0  0  0
   -6.1550    3.2570   -0.2150 H   0  0  0  0  0
   -4.2640    3.2420   -0.9430 H   0  0  0  0  0
  1 31  1  0  0  0
  2 32  1  0  0  0
  2 33  1  0  0  0
  3 25  1  0  0  0
  3  4  1  0  0  0
  3 34  1  0  0  0
  3 35  1  0  0  0
  4 36  1  0  0  0
  5 37  1  0  0  0
  6 28  1  0  0  0
  6  5  1  0  0  0
  6 30  1  0  0  0
  6 38  1  0  0  0
  7  8  1  0  0  0
  7 39  1  0  0  0
  7 40  1  0  0  0
  8 17  1  0  0  0
  8 41  1  0  0  0
  9 13  1  0  0  0
  9 42  1  0  0  0
 10 19  1  0  0  0
 10 43  1  0  0  0
 11 12  1  0  0  0
 11 44  1  0  0  0
 11 45  1  0  0  0
 11 46  1  0  0  0
 12  9  1  0  0  0
 13 14  1  0  0  0
 13 10  1  0  0  0
 13 47  1  0  0  0
 14 48  1  0  0  0
 15  9  1  0  0  0
 15  8  1  0  0  0
 16  7  1  0  0  0
 16 49  1  0  0  0
 17 18  1  0  0  0
 17 10  1  0  0  0
 17 50  1  0  0  0
 18 51  1  0  0  0
 19  2  1  0  0  0
 20  2  1  0  0  0
 20  1  2  0  0  0
 21 20  1  0  0  0
 22 21  2  0  0  0
 22 23  1  0  0  0
 23  5  1  0  0  0
 23  1  1  0  0  0
 24  4  1  0  0  0
 24  5  1  0  0  0
 25 52  1  0  0  0
 26  4  1  0  0  0
 26 28  1  0  0  0
 26 53  1  0  0  0
 27 26  1  0  0  0
 27 54  1  0  0  0
 28 55  1  0  0  0
 29 28  1  0  0  0
 29 56  1  0  0  0
 30 57  1  0  0  0
M  END
$$$$
