5A4
  CCTOOLS-0919241035

 56 58  0  0  1  0  0  0  0  0999 V2000
   -1.4190   -2.6530   -1.2720 C   0  0  0  0  0
   -0.8710   -4.4710    1.9380 C   0  0  0  0  0
   -0.4900   -3.8130    0.6100 C   0  0  0  0  0
    0.8470   -1.9960   -0.4580 C   0  0  0  0  0
    6.8510    3.0950    0.6710 C   0  0  0  0  0
    3.0660   -1.1360   -0.2620 C   0  0  0  0  0
   -1.7820    0.4790   -0.8120 C   0  0  0  0  0
   -4.2120    4.4490    2.2980 F   0  0  0  0  0
   -3.5910   -3.2020   -2.1240 C   0  0  0  0  0
   -0.4500   -1.4820   -1.0890 C   0  0  0  0  0
   -1.0510   -0.4850   -0.2210 O   0  0  0  0  0
   -2.6520   -2.1710   -1.8090 O   0  0  0  0  0
    0.5170   -2.6890    0.8680 C   0  0  0  0  0
   -1.6600   -3.2720   -0.0060 O   0  0  0  0  0
    1.7440   -0.8810   -0.2120 O   0  0  0  0  0
   -0.0490   -1.7400    1.7750 O   0  0  0  0  0
   -1.7200   -5.5930    1.6870 O   0  0  0  0  0
    3.4580   -2.2600   -0.5040 O   0  0  0  0  0
   -1.9140    0.4880   -2.0190 O   0  0  0  0  0
   -2.4230    1.5260    0.0080 C   0  0  0  0  0
    4.0370   -0.0500   -0.0230 C   0  0  0  0  0
    3.5890    1.2420    0.2610 C   0  0  0  0  0
    5.4080   -0.3110   -0.0750 C   0  0  0  0  0
    4.5020    2.2520    0.4840 C   0  0  0  0  0
    6.3100    0.7080    0.1500 C   0  0  0  0  0
    5.8590    1.9870    0.4260 C   0  0  0  0  0
   -3.2740    1.1720    1.0570 C   0  0  0  0  0
   -2.1760    2.8750   -0.2590 C   0  0  0  0  0
   -3.8690    2.1530    1.8200 C   0  0  0  0  0
   -2.7760    3.8480    0.5100 C   0  0  0  0  0
   -1.2700    3.2590   -1.3650 N   0  3  0  0  0
   -3.6250    3.4900    1.5470 C   0  0  0  0  0
   -1.1490    4.4300   -1.6740 O   0  0  0  0  0
   -0.6460    2.4020   -1.9660 O   0  5  0  0  0
   -0.9840   -3.3820   -1.9560 H   0  0  0  0  0
    0.0310   -4.8060    2.4500 H   0  0  0  0  0
   -1.3970   -3.7500    2.5630 H   0  0  0  0  0
   -0.0430   -4.5570   -0.0490 H   0  0  0  0  0
    1.3250   -2.7070   -1.1320 H   0  0  0  0  0
    7.0890    3.1420    1.7340 H   0  0  0  0  0
    7.7600    2.9010    0.1020 H   0  0  0  0  0
    6.4200    4.0450    0.3540 H   0  0  0  0  0
   -3.1570   -3.8740   -2.8650 H   0  0  0  0  0
   -3.8310   -3.7630   -1.2220 H   0  0  0  0  0
   -4.5000   -2.7550   -2.5270 H   0  0  0  0  0
   -0.2300   -1.0360   -2.0600 H   0  0  0  0  0
    1.4270   -3.1070    1.2980 H   0  0  0  0  0
   -0.2870   -2.1120    2.6350 H   0  0  0  0  0
   -2.0020   -6.0600    2.4860 H   0  0  0  0  0
    2.5310    1.4500    0.3060 H   0  0  0  0  0
    5.7610   -1.3090   -0.2890 H   0  0  0  0  0
    4.1570    3.2510    0.7030 H   0  0  0  0  0
    7.3710    0.5080    0.1110 H   0  0  0  0  0
   -3.4660    0.1300    1.2700 H   0  0  0  0  0
   -4.5280    1.8800    2.6320 H   0  0  0  0  0
   -2.5860    4.8910    0.3050 H   0  0  0  0  0
  1 12  1  0  0  0
  1 10  1  0  0  0
  1 14  1  0  0  0
  1 35  1  0  0  0
  2 36  1  0  0  0
  2 37  1  0  0  0
  3 14  1  0  0  0
  3 13  1  0  0  0
  3  2  1  0  0  0
  3 38  1  0  0  0
  4 10  1  0  0  0
  4 15  1  0  0  0
  4 13  1  0  0  0
  4 39  1  0  0  0
  5 40  1  0  0  0
  5 41  1  0  0  0
  5 42  1  0  0  0
  6 21  1  0  0  0
  6 15  1  0  0  0
  7 20  1  0  0  0
  9 12  1  0  0  0
  9 43  1  0  0  0
  9 44  1  0  0  0
  9 45  1  0  0  0
 10 11  1  0  0  0
 10 46  1  0  0  0
 11  7  1  0  0  0
 13 16  1  0  0  0
 13 47  1  0  0  0
 16 48  1  0  0  0
 17  2  1  0  0  0
 17 49  1  0  0  0
 18  6  2  0  0  0
 19  7  2  0  0  0
 20 27  2  0  0  0
 20 28  1  0  0  0
 21 23  2  0  0  0
 22 24  2  0  0  0
 22 21  1  0  0  0
 22 50  1  0  0  0
 23 25  1  0  0  0
 23 51  1  0  0  0
 24 26  1  0  0  0
 24 52  1  0  0  0
 25 53  1  0  0  0
 26  5  1  0  0  0
 26 25  2  0  0  0
 27 29  1  0  0  0
 27 54  1  0  0  0
 28 30  2  0  0  0
 29 32  2  0  0  0
 29 55  1  0  0  0
 30 32  1  0  0  0
 30 56  1  0  0  0
 31 28  1  0  0  0
 31 33  2  0  0  0
 32  8  1  0  0  0
 34 31  1  0  0  0
M  CHG  1  31   1
M  CHG  1  34  -1
M  END
$$$$
