PQE
  CCTOOLS-0919241033

 97 96  0  0  0  0  0  0  0  0999 V2000
   18.4210    8.6960   11.3910 O   0  0  0  0  0
   18.6120    8.9420   10.0030 C   0  0  0  0  0
   17.8620   10.2020    9.6160 C   0  0  0  0  0
   16.4770   10.0150    9.8710 O   0  0  0  0  0
   15.7220   11.1700    9.5260 C   0  0  0  0  0
   14.2550   10.9010    9.7960 C   0  0  0  0  0
   13.8280    9.8080    8.9950 O   0  0  0  0  0
   12.4610    9.4960    9.2230 C   0  0  0  0  0
   12.0690    8.3210    8.3370 C   0  0  0  0  0
   10.6100    7.9210    8.5440 C   0  0  0  0  0
   10.2380    6.7120    7.6810 C   0  0  0  0  0
    8.7760    6.3140    7.8460 C   0  0  0  0  0
    8.4880    5.1800    7.0400 O   0  0  0  0  0
    7.1290    4.7800    7.1700 C   0  0  0  0  0
    6.8780    3.5840    6.2720 C   0  0  0  0  0
    7.7480    2.5280    6.6520 O   0  0  0  0  0
    7.5560    1.3750    5.8400 C   0  0  0  0  0
    8.5260    0.2950    6.2770 C   0  0  0  0  0
    8.2930   -0.0120    7.6440 O   0  0  0  0  0
    9.1780   -1.0240    8.1090 C   0  0  0  0  0
    8.8830   -1.3080    9.5690 C   0  0  0  0  0
    9.0920   -0.1220   10.3230 O   0  0  0  0  0
    8.8080   -0.3240   11.7020 C   0  0  0  0  0
    9.0490    0.9720   12.4520 C   0  0  0  0  0
    8.2110    1.9840   11.9110 O   0  0  0  0  0
    8.3780    3.2200   12.5920 C   0  0  0  0  0
    7.4640    4.2760   11.9830 C   0  0  0  0  0
    7.5880    5.6280   12.6930 C   0  0  0  0  0
    6.6410    6.6640   12.0810 C   0  0  0  0  0
    6.7450    8.0440   12.7370 C   0  0  0  0  0
    5.8150    9.0850   12.1070 C   0  0  0  0  0
    5.9280   10.4690   12.7550 C   0  0  0  0  0
    7.2860   11.1660   12.6170 C   0  0  0  0  0
    7.6740   11.4610   11.1660 C   0  0  0  0  0
    8.9900   12.2350   11.0350 C   0  0  0  0  0
    9.3680   12.5550    9.5880 C   0  0  0  0  0
   10.7160   13.2560    9.5100 C   0  0  0  0  0
   19.3050    8.6420   11.7890 H   0  0  0  0  0
   19.6850    9.0490    9.8200 H   0  0  0  0  0
   18.2270    8.0820    9.4470 H   0  0  0  0  0
   17.9860   10.4240    8.5520 H   0  0  0  0  0
   18.2080   11.0520   10.2130 H   0  0  0  0  0
   16.0880   12.0080   10.1270 H   0  0  0  0  0
   15.8840   11.3800    8.4640 H   0  0  0  0  0
   13.6410   11.7710    9.5420 H   0  0  0  0  0
   14.1010   10.6360   10.8470 H   0  0  0  0  0
   12.3330    9.2460   10.2810 H   0  0  0  0  0
   11.8580   10.3790    8.9890 H   0  0  0  0  0
   12.2460    8.5840    7.2870 H   0  0  0  0  0
   12.7300    7.4710    8.5480 H   0  0  0  0  0
    9.9610    8.7700    8.2980 H   0  0  0  0  0
   10.4420    7.6810    9.6010 H   0  0  0  0  0
   10.8730    5.8590    7.9470 H   0  0  0  0  0
   10.4300    6.9550    6.6280 H   0  0  0  0  0
    8.5740    6.0550    8.8900 H   0  0  0  0  0
    8.1110    7.1330    7.5530 H   0  0  0  0  0
    6.9460    4.5310    8.2190 H   0  0  0  0  0
    6.4950    5.6210    6.8740 H   0  0  0  0  0
    7.0760    3.8290    5.2240 H   0  0  0  0  0
    5.8470    3.2340    6.3800 H   0  0  0  0  0
    6.5190    1.0460    5.9570 H   0  0  0  0  0
    7.7380    1.6560    4.7990 H   0  0  0  0  0
    9.5630    0.6300    6.1740 H   0  0  0  0  0
    8.3730   -0.6160    5.6900 H   0  0  0  0  0
    9.0270   -1.9180    7.4950 H   0  0  0  0  0
   10.2040   -0.6640    7.9890 H   0  0  0  0  0
    9.5470   -2.0840    9.9630 H   0  0  0  0  0
    7.8410   -1.6150    9.6960 H   0  0  0  0  0
    7.7650   -0.6430   11.7920 H   0  0  0  0  0
    9.4680   -1.1120   12.0770 H   0  0  0  0  0
   10.0880    1.2990   12.3500 H   0  0  0  0  0
    8.8030    0.8530   13.5110 H   0  0  0  0  0
    8.1250    3.0680   13.6460 H   0  0  0  0  0
    9.4280    3.5220   12.5220 H   0  0  0  0  0
    7.7170    4.4080   10.9240 H   0  0  0  0  0
    6.4270    3.9250   12.0370 H   0  0  0  0  0
    7.3570    5.5050   13.7580 H   0  0  0  0  0
    8.6220    5.9820   12.6240 H   0  0  0  0  0
    5.6080    6.3120   12.1880 H   0  0  0  0  0
    6.8340    6.7510   11.0050 H   0  0  0  0  0
    6.4950    7.9370   13.8000 H   0  0  0  0  0
    7.7850    8.3860   12.6870 H   0  0  0  0  0
    6.0070    9.1660   11.0320 H   0  0  0  0  0
    4.7770    8.7460   12.2100 H   0  0  0  0  0
    5.1520   11.1160   12.3250 H   0  0  0  0  0
    5.6940   10.3790   13.8230 H   0  0  0  0  0
    8.0670   10.5640   13.0960 H   0  0  0  0  0
    7.2310   12.1040   13.1800 H   0  0  0  0  0
    7.7920   10.5180   10.6200 H   0  0  0  0  0
    6.8690   12.0160   10.6710 H   0  0  0  0  0
    8.9310   13.1620   11.6180 H   0  0  0  0  0
    9.7870   11.6300   11.4850 H   0  0  0  0  0
    8.6120   13.2010    9.1290 H   0  0  0  0  0
    9.4090   11.6310    9.0000 H   0  0  0  0  0
   11.5110   12.6260    9.9230 H   0  0  0  0  0
   10.9670   13.4790    8.4680 H   0  0  0  0  0
   10.7010   14.1990   10.0650 H   0  0  0  0  0
  1  2  1  0  0  0
  1 38  1  0  0  0
  2  3  1  0  0  0
  2 39  1  0  0  0
  2 40  1  0  0  0
  3  4  1  0  0  0
  3 41  1  0  0  0
  3 42  1  0  0  0
  4  5  1  0  0  0
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  6  7  1  0  0  0
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  7  8  1  0  0  0
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  8 47  1  0  0  0
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  9 10  1  0  0  0
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  9 50  1  0  0  0
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 11 12  1  0  0  0
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 37 96  1  0  0  0
 37 97  1  0  0  0
M  END
$$$$
