A1CR8
  CCTOOLS-0724261005

 48 48  0  0  1  0  0  0  0  0999 V2000
    2.7220    1.7430   -0.0330 O   0  0  0  0  0
   -0.0270   -1.5710    0.4380 C   0  0  0  0  0
    3.4460   -3.0650    0.2510 C   0  0  0  0  0
    3.6490   -0.7770    0.0730 C   0  0  0  0  0
    4.1840   -1.9810    0.1160 N   0  0  0  0  0
   -1.8990   -1.6070   -1.0300 C   0  0  0  0  0
    4.1090   -4.4180    0.2950 C   0  0  0  0  0
    2.2820   -0.6040    0.1800 C   0  0  0  0  0
   -2.7800   -1.4250    0.1790 C   0  0  0  0  0
   -3.6300   -0.1650    0.0050 C   0  0  0  0  0
   -4.4320    0.0900    1.2820 C   0  0  0  0  0
   -5.1860    1.4150    1.1560 C   0  0  0  0  0
   -5.9890    1.6700    2.4330 C   0  0  0  0  0
   -4.5760   -0.3530   -1.1530 C   0  0  0  0  0
    2.0660   -2.9730    0.3590 C   0  0  0  0  0
    1.4680   -1.7170    0.3230 C   0  0  0  0  0
    1.6810    0.7770    0.1300 C   0  0  0  0  0
   -0.6260   -1.6160   -0.8990 N   0  0  0  0  0
    1.3090   -4.0930    0.4980 O   0  0  0  0  0
    3.8440    4.1160   -0.1760 O   0  0  0  0  0
   -5.7690   -0.2900   -0.9750 O   0  0  0  0  0
   -4.0930   -0.5910   -2.3830 O   0  0  0  0  0
    1.6000    3.6440   -1.4620 O   0  0  0  0  0
    1.6710    3.7610    1.0590 O   0  0  0  0  0
    2.4430    3.3260   -0.1270 P   0  0  0  0  0
   -0.4270   -2.3840    1.0430 H   0  0  0  0  0
   -0.2640   -0.6170    0.9100 H   0  0  0  0  0
    4.2880    0.0870   -0.0380 H   0  0  0  0  0
   -2.3410   -1.7300   -2.0070 H   0  0  0  0  0
    4.3490   -4.6720    1.3270 H   0  0  0  0  0
    3.4320   -5.1670   -0.1160 H   0  0  0  0  0
    5.0250   -4.3930   -0.2960 H   0  0  0  0  0
   -3.4320   -2.2910    0.2870 H   0  0  0  0  0
   -2.1590   -1.3240    1.0690 H   0  0  0  0  0
   -2.9800    0.6880   -0.1920 H   0  0  0  0  0
   -5.1450   -0.7210    1.4310 H   0  0  0  0  0
   -3.7540    0.1380    2.1340 H   0  0  0  0  0
   -4.4730    2.2260    1.0070 H   0  0  0  0  0
   -5.8650    1.3670    0.3040 H   0  0  0  0  0
   -6.7020    0.8590    2.5820 H   0  0  0  0  0
   -5.3100    1.7180    3.2850 H   0  0  0  0  0
   -6.5260    2.6140    2.3430 H   0  0  0  0  0
    1.1450    0.9750    1.0580 H   0  0  0  0  0
    0.9900    0.8420   -0.7100 H   0  0  0  0  0
    3.7520    5.0770   -0.2320 H   0  0  0  0  0
   -4.7380   -0.7050   -3.0940 H   0  0  0  0  0
    2.0460    3.3840   -2.2790 H   0  0  0  0  0
    1.1630   -4.3580    1.4160 H   0  0  0  0  0
  1 17  1  0  0  0
  2 16  1  0  0  0
  2 26  1  0  0  0
  2 27  1  0  0  0
  3  5  2  0  0  0
  3  7  1  0  0  0
  4  5  1  0  0  0
  4 28  1  0  0  0
  6 18  2  0  0  0
  6 29  1  0  0  0
  7 30  1  0  0  0
  7 31  1  0  0  0
  7 32  1  0  0  0
  8  4  2  0  0  0
  9  6  1  0  0  0
  9 33  1  0  0  0
  9 34  1  0  0  0
 10 11  1  0  0  0
 10  9  1  0  0  0
 10 35  1  0  0  0
 11 12  1  0  0  0
 11 36  1  0  0  0
 11 37  1  0  0  0
 12 13  1  0  0  0
 12 38  1  0  0  0
 12 39  1  0  0  0
 13 40  1  0  0  0
 13 41  1  0  0  0
 13 42  1  0  0  0
 14 10  1  0  0  0
 15  3  1  0  0  0
 16  8  1  0  0  0
 16 15  2  0  0  0
 17  8  1  0  0  0
 17 43  1  0  0  0
 17 44  1  0  0  0
 18  2  1  0  0  0
 19 15  1  0  0  0
 19 48  1  0  0  0
 20 25  1  0  0  0
 20 45  1  0  0  0
 21 14  2  0  0  0
 22 14  1  0  0  0
 22 46  1  0  0  0
 23 47  1  0  0  0
 24 25  2  0  0  0
 25 23  1  0  0  0
 25  1  1  0  0  0
M  END
$$$$
