PUBCHEM-ZINC05115741
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 22  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.4250    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060   -0.6070   -1.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6580   -1.9880   -1.1230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2760   -2.6000   -2.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8430   -1.8150   -3.2240 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7790   -0.4220   -3.1370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1640    0.1670   -2.0690 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3730    0.4150   -4.2040 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3170    1.6290   -4.1270 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9180   -0.1110   -5.1580 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.3680   -2.6720   -4.1380 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1650   -3.8980   -3.7550 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4950   -3.9130   -2.5690 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2230   -4.7010   -2.0720 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8020    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.7860   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7760    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2210   -2.5870   -0.3380 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1130    1.2440   -2.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4800   -4.7770   -4.2980 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4 19  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  6  7  2  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 20  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 21  1  0  0  0  0
 14 15  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END