XCO
  CCTOOLS-0807261403

 52 75  0  0  1  0  0  0  0  0999 V2000
    0.7490   -4.9160   -1.9530 O   0  6  0  0  0
    4.4260   -0.2230    0.9720 O   0  6  0  0  0
    0.6880    2.6870    2.9430 O   0  6  0  0  0
   -1.2640   -3.3430   -1.4190 O   0  6  0  0  0
   -0.4530   -3.6610   -0.2690 O   0  6  0  0  0
    1.3740   -3.4560   -0.0260 O   0  6  0  0  0
   -0.3970   -3.1200   -3.1140 O   0  6  0  0  0
   -1.9800   -2.0520   -2.6870 O   0  6  0  0  0
   -1.8130   -0.4020   -2.9190 O   0  6  0  0  0
   -0.5290    0.3710   -3.5910 O   0  6  0  0  0
   -1.1070   -1.5690   -4.9970 O   0  6  0  0  0
   -2.7520   -0.2160   -0.2310 O   0  6  0  0  0
   -2.2940   -1.6820    0.9050 O   0  6  0  0  0
   -1.1250   -1.0750   -0.1760 O   0  6  0  0  0
    0.8520   -3.8140    0.8440 O   0  6  0  0  0
   -2.0860    1.3720   -2.6700 O   0  6  0  0  0
   -1.6530    2.4700   -1.4640 O   0  6  0  0  0
   -2.2610    0.6370    1.6010 O   0  6  0  0  0
    0.3610   -1.4030    2.5540 O   0  6  0  0  0
    1.8510   -1.6920    0.3230 O   0  6  0  0  0
   -0.4870    1.6750   -0.9100 O   0  6  0  0  0
   -3.6320   -2.4630   -0.9180 O   0  6  0  0  0
    0.0360    3.4870   -2.1030 O   0  6  0  0  0
   -1.1480    2.3510    1.3390 O   0  6  0  0  0
   -0.3040    0.5870    2.7350 O   0  6  0  0  0
    2.9100   -1.5600    2.0830 O   0  6  0  0  0
    2.7470    1.1040   -0.2000 O   0  6  0  0  0
    2.0710    1.0280    1.9310 O   0  6  0  0  0
    1.1040    3.0770    0.7990 O   0  6  0  0  0
   -0.2820   -1.5920   -1.6020 O   0  5  0  0  0
    1.1350   -0.9470    0.6250 O   0  5  0  0  0
   -0.0050    0.9970   -1.3750 O   0  5  0  0  0
   -0.7920   -3.6190    1.5250 O   0  6  0  0  0
   -0.2350    0.3370    0.4760 O   0  5  0  0  0
   -3.2190    0.4300   -2.2440 O   0  6  0  0  0
   -1.2230    2.8550   -4.1240 O   0  6  0  0  0
   -3.3000    2.1760    0.1960 O   0  6  0  0  0
   -1.9240   -1.1690    3.2070 O   0  6  0  0  0
    1.9030   -3.6550    2.8380 O   0  6  0  0  0
    0.5020   -3.2250   -1.6160 W   0  0  0  0  0
    2.6870   -0.2560    0.9220 W   0  0  0  0  0
    0.4550    1.6440    1.5700 W   0  0  0  0  0
   -0.4950   -1.3890   -3.3780 W   0  0  0  0  0
   -2.0220   -1.7870   -0.9180 W   0  0  0  0  0
   -0.0130   -2.2440    0.6430 W   0  0  0  0  0
   -1.6460    0.3270   -1.3300 W   0  0  0  0  0
   -0.4850    1.9690   -2.8210 W   0  0  0  0  0
   -1.8000    1.3040    0.0410 W   0  0  0  0  0
   -1.0740   -0.6540    1.7790 W   0  0  0  0  0
    1.4860   -2.4740    1.6270 W   0  0  0  0  0
    1.3990    2.4170   -1.0440 CO  0  0  0  0  0
    0.5910   -0.4070   -0.8270 SI  0  0  0  0  0
  1 40  2  0  0  0
  2 41  2  0  0  0
  3 42  2  0  0  0
  4 40  1  0  0  0
  4 44  1  0  0  0
  5 40  1  0  0  0
  5 45  1  0  0  0
  6 40  1  0  0  0
  6 50  1  0  0  0
  7 40  1  0  0  0
  7 43  1  0  0  0
  8 43  1  0  0  0
  8 44  1  0  0  0
  9 43  1  0  0  0
  9 46  1  0  0  0
 10 43  1  0  0  0
 10 47  1  0  0  0
 11 43  2  0  0  0
 12 44  1  0  0  0
 12 48  1  0  0  0
 13 44  1  0  0  0
 13 49  1  0  0  0
 14 45  1  0  0  0
 14 46  1  0  0  0
 15 45  1  0  0  0
 15 50  1  0  0  0
 16 46  1  0  0  0
 16 47  1  0  0  0
 17 47  1  0  0  0
 17 48  1  0  0  0
 18 48  1  0  0  0
 18 49  1  0  0  0
 19 49  1  0  0  0
 19 50  1  0  0  0
 20 41  1  0  0  0
 20 45  1  0  0  0
 21 46  1  0  0  0
 21 51  1  0  0  0
 22 44  2  0  0  0
 23 47  1  0  0  0
 23 51  1  0  0  0
 24 42  1  0  0  0
 24 48  1  0  0  0
 25 42  1  0  0  0
 25 49  1  0  0  0
 26 41  1  0  0  0
 26 50  1  0  0  0
 27 41  1  0  0  0
 27 51  1  0  0  0
 28 41  1  0  0  0
 28 42  1  0  0  0
 29 42  1  0  0  0
 29 51  1  0  0  0
 30 40  1  0  0  0
 30 43  1  0  0  0
 30 44  1  0  0  0
 30 52  1  0  0  0
 31 41  1  0  0  0
 31 45  1  0  0  0
 31 50  1  0  0  0
 31 52  1  0  0  0
 32 46  1  0  0  0
 32 47  1  0  0  0
 32 51  1  0  0  0
 32 52  1  0  0  0
 33 45  2  0  0  0
 34 42  1  0  0  0
 34 48  1  0  0  0
 34 49  1  0  0  0
 34 52  1  0  0  0
 35 46  1  0  0  0
 36 47  2  0  0  0
 37 48  2  0  0  0
 38 49  2  0  0  0
 39 50  2  0  0  0
M  CHG  1   1  -2
M  CHG  1   2  -2
M  CHG  1   3  -2
M  CHG  1   4  -2
M  CHG  1   5  -2
M  CHG  1   6  -2
M  CHG  1   7  -2
M  CHG  1   8  -2
M  CHG  1   9  -2
M  CHG  1  10  -2
M  CHG  1  11  -2
M  CHG  1  12  -2
M  CHG  1  13  -2
M  CHG  1  14  -2
M  CHG  1  15  -2
M  CHG  1  16  -2
M  CHG  1  17  -2
M  CHG  1  18  -2
M  CHG  1  19  -2
M  CHG  1  20  -2
M  CHG  1  21  -2
M  CHG  1  22  -2
M  CHG  1  23  -2
M  CHG  1  24  -2
M  CHG  1  25  -2
M  CHG  1  26  -2
M  CHG  1  27  -2
M  CHG  1  28  -2
M  CHG  1  29  -2
M  CHG  1  30  -1
M  CHG  1  31  -1
M  CHG  1  32  -1
M  CHG  1  33  -2
M  CHG  1  34  -1
M  CHG  1  35  -2
M  CHG  1  36  -2
M  CHG  1  37  -2
M  CHG  1  38  -2
M  CHG  1  39  -2
M  END
$$$$
