B23
  CCTOOLS-0919241031

 24 25  0  0  0  0  0  0  0  0999 V2000
    3.5660    1.1240   -1.2260 O   0  0  0  0  0
    3.5280    0.1010   -0.3470 C   0  0  0  0  0
    4.5620   -0.3380    0.1200 O   0  0  0  0  0
    2.2440   -0.4810    0.0430 C   0  0  0  0  0
    1.0290   -0.0900   -0.3980 O   0  0  0  0  0
    2.0630   -1.5270    0.9230 C   0  0  0  0  0
    0.6850   -1.7530    1.0020 C   0  0  0  0  0
    0.0810   -0.8500    0.1750 C   0  0  0  0  0
   -1.3730   -0.7290   -0.0540 C   0  0  0  0  0
   -2.1290   -1.8610   -0.3670 C   0  0  0  0  0
   -3.4870   -1.7410   -0.5790 C   0  0  0  0  0
   -4.1000   -0.5040   -0.4820 C   0  0  0  0  0
   -3.3560    0.6210   -0.1720 C   0  0  0  0  0
   -1.9990    0.5150    0.0480 C   0  0  0  0  0
   -1.2060    1.7190    0.3860 N   0  3  0  0  0
   -1.7530    2.8030    0.4740 O   0  5  0  0  0
   -0.0060    1.6240    0.5750 O   0  0  0  0  0
    4.4580    1.4410   -1.4230 H   0  0  0  0  0
    2.8360   -2.0680    1.4480 H   0  0  0  0  0
    0.1920   -2.5040    1.6020 H   0  0  0  0  0
   -1.6520   -2.8270   -0.4430 H   0  0  0  0  0
   -4.0730   -2.6150   -0.8220 H   0  0  0  0  0
   -5.1630   -0.4170   -0.6490 H   0  0  0  0  0
   -3.8400    1.5830   -0.0990 H   0  0  0  0  0
  1  2  1  0  0  0
  1 18  1  0  0  0
  2  3  2  0  0  0
  2  4  1  0  0  0
  4  5  1  0  0  0
  4  6  2  0  0  0
  5  8  1  0  0  0
  6  7  1  0  0  0
  6 19  1  0  0  0
  7  8  2  0  0  0
  7 20  1  0  0  0
  8  9  1  0  0  0
  9 10  1  0  0  0
  9 14  2  0  0  0
 10 11  2  0  0  0
 10 21  1  0  0  0
 11 12  1  0  0  0
 11 22  1  0  0  0
 12 13  2  0  0  0
 12 23  1  0  0  0
 13 14  1  0  0  0
 13 24  1  0  0  0
 14 15  1  0  0  0
 15 16  1  0  0  0
 15 17  2  0  0  0
M  CHG  1  15   1
M  CHG  1  16  -1
M  END
$$$$