M6T
  CCTOOLS-0919241033

 47 48  0  0  1  0  0  0  0  0999 V2000
    6.0240    2.0910    0.0390 N   0  0  0  0  0
    7.0520    1.3740   -0.3680 C   0  0  0  0  0
    8.2480    2.0770   -0.9570 C   0  0  0  0  0
    7.0610    0.0600   -0.2790 N   0  0  0  0  0
    6.0260   -0.5930    0.2410 C   0  0  0  0  0
    6.0410   -1.9740    0.3380 N   0  0  0  0  0
    4.9200    0.1370    0.6820 C   0  0  0  0  0
    4.9530    1.5130    0.5630 C   0  0  0  0  0
    3.7210   -0.5590    1.2720 C   0  0  0  0  0
    2.7200   -0.7800    0.2240 N   0  3  0  0  0
    3.0140   -0.4770   -1.0190 C   0  0  0  0  0
    1.5540   -0.9070   -1.8550 S   0  0  0  0  0
    0.6330   -1.4770   -0.4340 C   0  0  0  0  0
    1.5480   -1.2840    0.5500 C   0  0  0  0  0
    1.2270   -1.6290    1.9810 C   0  0  0  0  0
    3.7840    2.3460    1.0240 C   0  0  0  0  0
   -0.7680   -2.0250   -0.3520 C   0  0  0  0  0
   -1.7520   -0.8760   -0.1190 C   0  0  0  0  0
   -3.0810   -1.3960   -0.0410 O   0  0  0  0  0
   -4.0580   -0.1400    0.2040 P   0  0  0  0  0
   -3.7380    0.5180    1.6380 O   0  0  0  0  0
   -3.8440    0.8670   -0.8590 O   0  0  0  0  0
   -5.5890   -0.6370    0.1720 O   0  0  0  0  0
   -6.4950    0.6640   -0.1130 P   0  0  0  0  0
   -7.9750    0.2020   -0.5470 O   0  0  0  0  0
   -6.5780    1.5240    1.1670 O   0  0  0  0  0
   -5.8600    1.4940   -1.2510 O   0  5  0  0  0
    8.9560    2.3170   -0.1640 H   0  0  0  0  0
    8.7280    1.4270   -1.6880 H   0  0  0  0  0
    7.9240    2.9960   -1.4460 H   0  0  0  0  0
    5.3120   -2.4380    0.7790 H   0  0  0  0  0
    6.7810   -2.4790   -0.0360 H   0  0  0  0  0
    4.0260   -1.5180    1.6900 H   0  0  0  0  0
    3.2910    0.0610    2.0590 H   0  0  0  0  0
    3.9290   -0.0660   -1.4190 H   0  0  0  0  0
    1.5960   -2.6290    2.2060 H   0  0  0  0  0
    1.7040   -0.9070    2.6450 H   0  0  0  0  0
    0.1470   -1.5990    2.1280 H   0  0  0  0  0
    3.0830    2.4760    0.1990 H   0  0  0  0  0
    3.2830    1.8430    1.8510 H   0  0  0  0  0
    4.1420    3.3210    1.3540 H   0  0  0  0  0
   -1.0160   -2.5310   -1.2850 H   0  0  0  0  0
   -0.8340   -2.7320    0.4740 H   0  0  0  0  0
   -1.5050   -0.3700    0.8140 H   0  0  0  0  0
   -1.6870   -0.1680   -0.9450 H   0  0  0  0  0
    0.0000    0.0000    0.0000 H   0  0  0  0  0
    0.0000    0.0000    0.0000 H   0  0  0  0  0
  1  2  2  0  0  0
  1  8  1  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  3 28  1  0  0  0
  3 29  1  0  0  0
  3 30  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  6 31  1  0  0  0
  6 32  1  0  0  0
  7  8  2  0  0  0
  7  9  1  0  0  0
  8 16  1  0  0  0
  9 10  1  0  0  0
  9 33  1  0  0  0
  9 34  1  0  0  0
 10 11  2  0  0  0
 10 14  1  0  0  0
 11 12  1  0  0  0
 11 35  1  0  0  0
 12 13  1  0  0  0
 13 14  2  0  0  0
 13 17  1  0  0  0
 14 15  1  0  0  0
 15 36  1  0  0  0
 15 37  1  0  0  0
 15 38  1  0  0  0
 16 39  1  0  0  0
 16 40  1  0  0  0
 16 41  1  0  0  0
 17 18  1  0  0  0
 17 42  1  0  0  0
 17 43  1  0  0  0
 18 19  1  0  0  0
 18 44  1  0  0  0
 18 45  1  0  0  0
 19 20  1  0  0  0
 20 21  2  0  0  0
 20 22  1  0  0  0
 20 23  1  0  0  0
 22 46  1  0  0  0
 23 24  1  0  0  0
 24 25  2  0  0  0
 24 26  1  0  0  0
 24 27  1  0  0  0
 26 47  1  0  0  0
M  CHG  1  10   1
M  CHG  1  27  -1
M  END
$$$$
