Q83
  CCTOOLS-0410261002

 40 41  0  0  0  0  0  0  0  0999 V2000
    7.2390   -0.6990   -0.0010 C   0  0  0  0  0
    6.1680    0.3620   -0.0000 C   0  0  0  0  0
    4.7910   -0.3040   -0.0010 C   0  0  0  0  0
    3.7040    0.7730    0.0000 C   0  0  0  0  0
    2.3260    0.1070   -0.0000 C   0  0  0  0  0
    1.2390    1.1840    0.0010 C   0  0  0  0  0
   -0.1180    0.5280    0.0000 C   0  0  0  0  0
   -1.2320    1.2850    0.0010 N   0  0  0  0  0
   -4.7930   -2.2230   -0.0000 N   0  3  0  0  0
   -1.2520    2.7500   -0.0040 C   0  0  0  0  0
   -3.4740    1.8110    0.0020 C   0  0  0  0  0
   -4.8260    1.5250    0.0010 C   0  0  0  0  0
   -5.2570    0.2110    0.0010 C   0  0  0  0  0
   -4.3330   -0.8170   -0.0000 C   0  0  0  0  0
   -2.9830   -0.5350   -0.0010 C   0  0  0  0  0
   -2.5390    0.7880    0.0010 C   0  0  0  0  0
   -2.7410    3.1330   -0.0010 C   0  0  0  0  0
    8.5340   -0.3450    0.0040 O   0  0  0  0  0
    6.9320   -1.8670   -0.0030 O   0  0  0  0  0
   -0.2060   -0.6820   -0.0010 O   0  0  0  0  0
   -3.9800   -3.1300   -0.0010 O   0  0  0  0  0
   -5.9850   -2.4740    0.0010 O   0  5  0  0  0
    6.2720    0.9820    0.8900 H   0  0  0  0  0
    6.2720    0.9840   -0.8900 H   0  0  0  0  0
    4.6870   -0.9240   -0.8910 H   0  0  0  0  0
    4.6870   -0.9260    0.8880 H   0  0  0  0  0
    3.8070    1.3920    0.8910 H   0  0  0  0  0
    3.8070    1.3940   -0.8890 H   0  0  0  0  0
    2.2230   -0.5130   -0.8910 H   0  0  0  0  0
    2.2230   -0.5150    0.8890 H   0  0  0  0  0
    1.3430    1.8030    0.8920 H   0  0  0  0  0
    1.3430    1.8050   -0.8880 H   0  0  0  0  0
   -0.7600    3.1380    0.8880 H   0  0  0  0  0
   -0.7640    3.1320   -0.9000 H   0  0  0  0  0
   -5.5470    2.3290    0.0020 H   0  0  0  0  0
   -6.3140   -0.0120    0.0010 H   0  0  0  0  0
   -2.2650   -1.3430   -0.0000 H   0  0  0  0  0
   -2.9840    3.7070    0.8930 H   0  0  0  0  0
   -2.9890    3.7010   -0.8970 H   0  0  0  0  0
    9.1840   -1.0610    0.0070 H   0  0  0  0  0
  1 19  2  0  0  0
  1 18  1  0  0  0
  2  1  1  0  0  0
  2 23  1  0  0  0
  2 24  1  0  0  0
  3  2  1  0  0  0
  3 25  1  0  0  0
  3 26  1  0  0  0
  4  3  1  0  0  0
  4 27  1  0  0  0
  4 28  1  0  0  0
  5  4  1  0  0  0
  5 29  1  0  0  0
  5 30  1  0  0  0
  6  5  1  0  0  0
  6 31  1  0  0  0
  6 32  1  0  0  0
  7  6  1  0  0  0
  8  7  1  0  0  0
  8 16  1  0  0  0
  9 22  1  0  0  0
  9 21  2  0  0  0
 10  8  1  0  0  0
 10 33  1  0  0  0
 10 34  1  0  0  0
 11 12  2  0  0  0
 11 16  1  0  0  0
 12 13  1  0  0  0
 12 35  1  0  0  0
 13 14  2  0  0  0
 13 36  1  0  0  0
 14  9  1  0  0  0
 15 14  1  0  0  0
 15 37  1  0  0  0
 16 15  2  0  0  0
 17 10  1  0  0  0
 17 11  1  0  0  0
 17 38  1  0  0  0
 17 39  1  0  0  0
 18 40  1  0  0  0
 20  7  2  0  0  0
M  CHG  1   9   1
M  CHG  1  22  -1
M  END
$$$$
