I4O
  CCTOOLS-0626261020

 24 24  0  0  1  0  0  0  0  0999 V2000
    2.9990   -1.1650   -1.1700 N   0  0  0  0  0
    3.3990    0.0230   -0.4030 C   0  0  0  0  0
    4.8160   -0.1440    0.0800 C   0  0  0  0  0
    5.3070   -1.2470    0.1420 O   0  0  0  0  0
    2.4670    0.1920    0.7980 C   0  0  0  0  0
    1.0690    0.4820    0.3130 C   0  0  0  0  0
    0.7140    1.4710   -0.5200 N   0  0  0  0  0
   -0.0400   -0.2100    0.6360 C   0  0  0  0  0
   -0.5750    1.4210   -0.7220 C   0  0  0  0  0
   -1.0830    0.3870   -0.0190 N   0  0  0  0  0
    5.5330    0.9310    0.4430 O   0  0  0  0  0
   -2.9350   -0.1530    0.0470 V   0  0  0  0  0
   -4.6390   -0.6500    0.1060 O   0  5  0  0  0
   -2.9500    0.1090    1.8030 O   0  5  0  0  0
   -3.3610    1.1740   -1.0530 O   0  0  0  0  0
   -2.4950   -1.7430   -0.6100 O   0  5  0  0  0
    3.5590   -1.2620   -2.0040 H   0  0  0  0  0
    3.0510   -1.9960   -0.6010 H   0  0  0  0  0
    3.3340    0.9050   -1.0400 H   0  0  0  0  0
    2.4640   -0.7250    1.3880 H   0  0  0  0  0
    2.8160    1.0200    1.4160 H   0  0  0  0  0
   -0.0950   -1.0700    1.2860 H   0  0  0  0  0
   -1.1400    2.0940   -1.3500 H   0  0  0  0  0
    6.4380    0.7740    0.7470 H   0  0  0  0  0
  1 18  1  0  0  0
  1 17  1  0  0  0
  2  1  1  0  0  0
  2 19  1  0  0  0
  3  4  2  0  0  0
  3  2  1  0  0  0
  3 11  1  0  0  0
  5  6  1  0  0  0
  5  2  1  0  0  0
  5 20  1  0  0  0
  5 21  1  0  0  0
  6  8  2  0  0  0
  7  6  1  0  0  0
  7  9  2  0  0  0
  8 10  1  0  0  0
  8 22  1  0  0  0
  9 10  1  0  0  0
  9 23  1  0  0  0
 10 12  1  0  0  0
 11 24  1  0  0  0
 12 13  1  0  0  0
 12 15  2  0  0  0
 14 12  1  0  0  0
 16 12  1  0  0  0
M  CHG  1  13  -1
M  CHG  1  14  -1
M  CHG  1  16  -1
M  END
$$$$
