XLH
  CCTOOLS-0828261229

 44 46  0  0  1  0  0  0  0  0999 V2000
   -3.2100   -2.3140   -0.7110 C   0  0  0  0  0
   -1.7240   -0.3290   -0.5290 C   0  0  0  0  0
    5.6130   -0.6450    0.1130 C   0  0  0  0  0
   -3.0630   -0.9570   -0.4350 C   0  0  0  0  0
   -0.2990    1.5530   -0.2430 C   0  0  0  0  0
   -0.1160    2.8660   -0.6550 C   0  0  0  0  0
    1.1460    3.4280   -0.6280 C   0  0  0  0  0
    2.2270    2.6830   -0.1920 C   0  0  0  0  0
    2.0480    1.3740    0.2190 C   0  0  0  0  0
    0.7890    0.8080    0.1950 C   0  0  0  0  0
    3.2280    0.5660    0.6920 C   0  0  0  0  0
   -4.4690   -2.8870   -0.6200 C   0  0  0  0  0
   -5.5360   -2.0840   -0.2500 C   0  0  0  0  0
   -5.3150   -0.7420    0.0160 C   0  0  0  0  0
   -6.4720    0.1360    0.4190 C   0  0  0  0  0
    7.3450   -1.9080    0.5020 C   0  0  0  0  0
    7.2970   -0.7940   -1.7760 C   0  0  0  0  0
    3.8620    1.2510    1.9050 C   0  0  0  0  0
   -6.6070    0.1200    1.8110 F   0  0  0  0  0
   -6.2360    1.4460   -0.0120 F   0  0  0  0  0
   -7.6480   -0.3430   -0.1690 F   0  0  0  0  0
   -1.5760    0.9840   -0.2630 N   0  0  0  0  0
   -4.1120   -0.2210   -0.0900 N   0  0  0  0  0
    6.7730   -1.1020   -0.4430 N   0  0  0  0  0
    6.5550   -1.9100    1.5390 N   0  0  0  0  0
    5.5310   -1.1660    1.3150 N   0  0  0  0  0
   -0.7600   -0.9980   -0.8450 O   0  0  0  0  0
    4.4490    0.4440   -0.6380 S   0  0  0  0  0
   -2.3560   -2.9100   -0.9970 H   0  0  0  0  0
   -0.9590    3.4490   -0.9960 H   0  0  0  0  0
    1.2890    4.4490   -0.9490 H   0  0  0  0  0
    3.2120    3.1240   -0.1720 H   0  0  0  0  0
    0.6500   -0.2140    0.5170 H   0  0  0  0  0
    2.8950   -0.4330    0.9730 H   0  0  0  0  0
   -4.6150   -3.9360   -0.8330 H   0  0  0  0  0
   -6.5290   -2.5000   -0.1700 H   0  0  0  0  0
    8.2780   -2.4430    0.4080 H   0  0  0  0  0
    7.9300    0.0920   -1.7220 H   0  0  0  0  0
    7.8830   -1.6380   -2.1410 H   0  0  0  0  0
    6.4670   -0.6070   -2.4580 H   0  0  0  0  0
    3.1270    1.3240    2.7060 H   0  0  0  0  0
    4.7160    0.6660    2.2470 H   0  0  0  0  0
    4.1950    2.2500    1.6250 H   0  0  0  0  0
   -2.3550    1.5340   -0.0850 H   0  0  0  0  0
  1 12  1  0  0  0
  1 29  1  0  0  0
  2  4  1  0  0  0
  2 27  2  0  0  0
  3 24  1  0  0  0
  3 26  2  0  0  0
  4  1  2  0  0  0
  4 23  1  0  0  0
  5  6  2  0  0  0
  5 10  1  0  0  0
  5 22  1  0  0  0
  6  7  1  0  0  0
  6 30  1  0  0  0
  7  8  2  0  0  0
  7 31  1  0  0  0
  8  9  1  0  0  0
  8 32  1  0  0  0
  9 10  2  0  0  0
  9 11  1  0  0  0
 10 33  1  0  0  0
 11 28  1  0  0  0
 11 18  1  0  0  0
 11 34  1  0  0  0
 12 13  2  0  0  0
 12 35  1  0  0  0
 13 14  1  0  0  0
 13 36  1  0  0  0
 14 23  2  0  0  0
 14 15  1  0  0  0
 15 19  1  0  0  0
 15 20  1  0  0  0
 15 21  1  0  0  0
 16 25  2  0  0  0
 16 37  1  0  0  0
 17 38  1  0  0  0
 17 39  1  0  0  0
 17 40  1  0  0  0
 18 41  1  0  0  0
 18 42  1  0  0  0
 18 43  1  0  0  0
 22  2  1  0  0  0
 22 44  1  0  0  0
 24 16  1  0  0  0
 24 17  1  0  0  0
 25 26  1  0  0  0
 28  3  1  0  0  0
M  END
$$$$
