QQI
  CCTOOLS-0919241038

 49 52  0  0  1  0  0  0  0  0999 V2000
   -3.1000    1.1980   -0.5640 C   0  0  0  0  0
   -1.0730    0.1300   -0.2940 C   0  0  0  0  0
   -0.4260    1.0970   -1.0650 C   0  0  0  0  0
    1.0260    1.0080   -1.3150 C   0  0  0  0  0
    3.1780   -0.1010   -1.0450 C   0  0  0  0  0
    3.9440    0.6090    0.0510 C   0  0  0  0  0
    4.1720    1.9600    0.2550 C   0  0  0  0  0
   -5.0520    0.2260    0.3650 C   0  0  0  0  0
    2.5120   -2.5090   -1.3000 C   0  0  0  0  0
    3.6460   -1.5710   -0.9770 C   0  0  0  0  0
    4.0740   -1.7140    0.4990 C   0  0  0  0  0
    4.4580   -0.3180    0.9370 C   0  0  0  0  0
    5.2030    0.1100    2.0300 C   0  0  0  0  0
    5.4280    1.4630    2.2300 C   0  0  0  0  0
    4.9120    2.3860    1.3410 C   0  0  0  0  0
   -7.0300   -0.8870    1.2520 C   0  0  0  0  0
   -8.3140   -1.4660    0.6570 C   0  0  0  0  0
   -8.3770   -0.6070    1.9210 C   0  0  0  0  0
   -2.5210    2.1980   -1.3420 C   0  0  0  0  0
   -1.1770    2.1560   -1.5990 C   0  0  0  0  0
    1.7370   -0.0130   -0.7970 N   0  0  0  0  0
   -2.3680    0.2090   -0.0710 N   0  0  0  0  0
   -4.4620    1.2420   -0.2960 N   0  0  0  0  0
   -6.3890    0.2180    0.5330 N   0  0  0  0  0
    1.8560   -2.9940   -0.4080 O   0  0  0  0  0
    5.7100   -0.7990    2.9030 O   0  0  0  0  0
   -4.3770   -0.6820    0.8100 O   0  0  0  0  0
    1.5800    1.8560   -1.9880 O   0  0  0  0  0
    2.2300   -2.8070   -2.5780 O   0  0  0  0  0
   -0.5070   -0.6900    0.1220 H   0  0  0  0  0
    3.4210    0.3290   -2.0160 H   0  0  0  0  0
    3.7690    2.6830   -0.4380 H   0  0  0  0  0
    4.4890   -1.7400   -1.6470 H   0  0  0  0  0
    3.2430   -2.0840    1.0990 H   0  0  0  0  0
    4.9280   -2.3870    0.5810 H   0  0  0  0  0
    6.0070    1.7950    3.0800 H   0  0  0  0  0
    5.0880    3.4410    1.4950 H   0  0  0  0  0
   -6.3520   -1.5760    1.7550 H   0  0  0  0  0
   -8.6830   -1.0260   -0.2700 H   0  0  0  0  0
   -8.4820   -2.5380    0.7680 H   0  0  0  0  0
   -8.5860   -1.1120    2.8640 H   0  0  0  0  0
   -8.7870    0.3990    1.8260 H   0  0  0  0  0
   -3.1270    3.0000   -1.7390 H   0  0  0  0  0
   -0.7050    2.9200   -2.1990 H   0  0  0  0  0
    1.2940   -0.6890   -0.2600 H   0  0  0  0  0
   -4.9900    2.0030   -0.5860 H   0  0  0  0  0
   -6.9270    0.9420    0.1780 H   0  0  0  0  0
    6.5950   -1.1140    2.6740 H   0  0  0  0  0
    1.4940   -3.4140   -2.7360 H   0  0  0  0  0
  1 22  2  0  0  0
  2  3  2  0  0  0
  2 30  1  0  0  0
  3  4  1  0  0  0
  3 20  1  0  0  0
  4 21  1  0  0  0
  5  6  1  0  0  0
  5 31  1  0  0  0
  6  7  2  0  0  0
  7 15  1  0  0  0
  7 32  1  0  0  0
  8 23  1  0  0  0
  9 25  2  0  0  0
 10  9  1  0  0  0
 10  5  1  0  0  0
 10 33  1  0  0  0
 11 10  1  0  0  0
 11 34  1  0  0  0
 11 35  1  0  0  0
 12 11  1  0  0  0
 12  6  1  0  0  0
 13 12  2  0  0  0
 14 13  1  0  0  0
 14 36  1  0  0  0
 15 14  2  0  0  0
 15 37  1  0  0  0
 16 24  1  0  0  0
 16 18  1  0  0  0
 16 38  1  0  0  0
 17 16  1  0  0  0
 17 39  1  0  0  0
 17 40  1  0  0  0
 18 17  1  0  0  0
 18 41  1  0  0  0
 18 42  1  0  0  0
 19  1  1  0  0  0
 19 43  1  0  0  0
 20 19  2  0  0  0
 20 44  1  0  0  0
 21  5  1  0  0  0
 21 45  1  0  0  0
 22  2  1  0  0  0
 23  1  1  0  0  0
 23 46  1  0  0  0
 24  8  1  0  0  0
 24 47  1  0  0  0
 26 13  1  0  0  0
 26 48  1  0  0  0
 27  8  2  0  0  0
 28  4  2  0  0  0
 29  9  1  0  0  0
 29 49  1  0  0  0
M  END
$$$$
