LUP
  CCTOOLS-0919241031

 70 73  0  0  0  0  0  0  0  0999 V2000
   -3.7540    0.7270    1.9260 C   0  0  0  0  0
   -0.4820   -0.8110    0.6020 C   0  0  0  0  0
    4.1100   -1.3200   -0.6100 C   0  0  0  0  0
    3.5310   -1.5820    0.7820 C   0  0  0  0  0
    2.5350   -2.7440    0.7060 C   0  0  0  0  0
    6.3640   -0.4940   -0.1930 C   0  0  0  0  0
    7.3530    0.6090   -0.1170 C   0  0  0  0  0
    9.1850    1.7730    0.1510 C   0  0  0  0  0
  -10.6290    1.5100   -0.5360 C   0  0  0  0  0
   -9.1550    1.4410   -0.9420 C   0  0  0  0  0
   -8.3110    1.0390    0.2690 C   0  0  0  0  0
   -6.8370    0.9700   -0.1370 C   0  0  0  0  0
   -4.6030    0.5080    0.6720 C   0  0  0  0  0
   -2.2710    0.6470    1.5580 C   0  0  0  0  0
   -1.9650   -0.7320    0.9700 C   0  0  0  0  0
    1.9810   -2.0830   -1.6710 C   0  0  0  0  0
    2.9830   -0.9290   -1.5680 C   0  0  0  0  0
    8.7300    0.5010    0.2270 C   0  0  0  0  0
   10.5920    2.2420    0.4170 C   0  0  0  0  0
   -2.8140   -0.9510   -0.2840 C   0  0  0  0  0
   -4.2970   -0.8710    0.0840 C   0  0  0  0  0
  -10.7880    2.4590    0.4800 F   0  0  0  0  0
  -11.4010    1.8780   -1.6430 F   0  0  0  0  0
  -11.0440    0.2570   -0.0730 F   0  0  0  0  0
   -6.0270    0.5840    1.0260 N   0  0  0  0  0
    1.5280   -2.4380   -0.3190 N   0  0  0  0  0
    5.0870   -0.2310   -0.5350 N   0  0  0  0  0
    7.1370    1.8780   -0.3580 N   0  0  0  0  0
   -0.1740   -3.4100    1.1240 O   0  0  0  0  0
   -0.7160   -2.7630   -1.2020 O   0  0  0  0  0
    6.7050   -1.6330    0.0530 O   0  0  0  0  0
    8.1440    2.5330   -0.2160 O   0  0  0  0  0
   -0.0870   -2.4910    0.0430 S   0  0  0  0  0
   10.8360    3.7520    0.4670 C   0  0  0  0  0
   11.3340    2.9360   -0.7270 C   0  0  0  0  0
   -3.9720    1.7090    2.3450 H   0  0  0  0  0
   -3.9870   -0.0420    2.6620 H   0  0  0  0  0
   -0.2670   -0.1020   -0.1980 H   0  0  0  0  0
    0.1230   -0.5680    1.4760 H   0  0  0  0  0
    4.6000   -2.2230   -0.9750 H   0  0  0  0  0
    4.3370   -1.8380    1.4690 H   0  0  0  0  0
    3.0200   -0.6870    1.1370 H   0  0  0  0  0
    3.0620   -3.6600    0.4390 H   0  0  0  0  0
    2.0470   -2.8700    1.6720 H   0  0  0  0  0
   -9.0310    0.7020   -1.7330 H   0  0  0  0  0
   -8.8320    2.4180   -1.3020 H   0  0  0  0  0
   -8.4350    1.7790    1.0610 H   0  0  0  0  0
   -8.6340    0.0630    0.6300 H   0  0  0  0  0
   -6.7130    0.2310   -0.9280 H   0  0  0  0  0
   -6.5140    1.9470   -0.4980 H   0  0  0  0  0
   -4.3690    1.2770   -0.0640 H   0  0  0  0  0
   -2.0370    1.4160    0.8220 H   0  0  0  0  0
   -1.6660    0.8030    2.4520 H   0  0  0  0  0
   -2.1980   -1.5010    1.7060 H   0  0  0  0  0
    1.1270   -1.7740   -2.2730 H   0  0  0  0  0
    2.4620   -2.9440   -2.1350 H   0  0  0  0  0
    2.4770   -0.0400   -1.1910 H   0  0  0  0  0
    3.3990   -0.7200   -2.5540 H   0  0  0  0  0
    9.2820   -0.3890    0.4880 H   0  0  0  0  0
   11.1780    1.6150    1.0890 H   0  0  0  0  0
   -2.5800   -0.1820   -1.0200 H   0  0  0  0  0
   -2.5960   -1.9330   -0.7030 H   0  0  0  0  0
   -4.5300   -1.6400    0.8200 H   0  0  0  0  0
   -4.9010   -1.0270   -0.8090 H   0  0  0  0  0
   -6.1740    1.2190    1.7960 H   0  0  0  0  0
    4.8150    0.6790   -0.7320 H   0  0  0  0  0
    9.9780    4.4050    0.3080 H   0  0  0  0  0
   11.5820    4.1180    1.1730 H   0  0  0  0  0
   12.4080    2.7650   -0.8080 H   0  0  0  0  0
   10.8040    3.0530   -1.6730 H   0  0  0  0  0
  1 13  1  0  0  0
  1 36  1  0  0  0
  1 37  1  0  0  0
  2 15  1  0  0  0
  2 38  1  0  0  0
  2 39  1  0  0  0
  3 17  1  0  0  0
  3 40  1  0  0  0
  4  5  1  0  0  0
  4  3  1  0  0  0
  4 41  1  0  0  0
  4 42  1  0  0  0
  5 26  1  0  0  0
  5 43  1  0  0  0
  5 44  1  0  0  0
  6 31  2  0  0  0
  7 18  1  0  0  0
  7  6  1  0  0  0
  8 19  1  0  0  0
  8 18  2  0  0  0
  9 22  1  0  0  0
 10  9  1  0  0  0
 10 11  1  0  0  0
 10 45  1  0  0  0
 10 46  1  0  0  0
 11 47  1  0  0  0
 11 48  1  0  0  0
 12 25  1  0  0  0
 12 11  1  0  0  0
 12 49  1  0  0  0
 12 50  1  0  0  0
 13 25  1  0  0  0
 13 21  1  0  0  0
 13 51  1  0  0  0
 14  1  1  0  0  0
 14 15  1  0  0  0
 14 52  1  0  0  0
 14 53  1  0  0  0
 15 20  1  0  0  0
 15 54  1  0  0  0
 16 55  1  0  0  0
 16 56  1  0  0  0
 17 16  1  0  0  0
 17 57  1  0  0  0
 17 58  1  0  0  0
 18 59  1  0  0  0
 19 35  1  0  0  0
 19 60  1  0  0  0
 20 21  1  0  0  0
 20 61  1  0  0  0
 20 62  1  0  0  0
 21 63  1  0  0  0
 21 64  1  0  0  0
 23  9  1  0  0  0
 24  9  1  0  0  0
 25 65  1  0  0  0
 26 16  1  0  0  0
 27  3  1  0  0  0
 27  6  1  0  0  0
 27 66  1  0  0  0
 28  7  2  0  0  0
 29 33  2  0  0  0
 30 33  2  0  0  0
 32 28  1  0  0  0
 32  8  1  0  0  0
 33 26  1  0  0  0
 33  2  1  0  0  0
 34 19  1  0  0  0
 34 35  1  0  0  0
 34 67  1  0  0  0
 34 68  1  0  0  0
 35 69  1  0  0  0
 35 70  1  0  0  0
M  END
$$$$
