NCID-ZINC01587259
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3930    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2230   -0.6820   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4040    0.0280   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3800    1.4180   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1670    2.0960    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1480    3.5760    0.0100 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0850    4.1720    0.0230 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1940    4.1990    0.0030 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.2360   -0.9870   -0.0430 I   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2650   -0.7610    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3270   -0.1690    0.0240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2450   -2.1090    0.0030 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9590    1.9210    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2420   -1.7620   -0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3970   -2.5810   -0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0770   -2.6060    0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5450    2.1150   -0.0200 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8740    2.3210   -0.9050 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 16  1  0  0  0  0
 13 17  1  0  0  0  0
 18 19  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END