PUBCHEM-ZINC04085837
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  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
    0.6040   -0.6060   -1.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6640   -1.9910   -1.1330 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2920   -2.5660   -2.2350 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8110   -1.7740   -3.1700 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7350   -0.4560   -3.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1400    0.1230   -2.0270 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2860    0.3360   -4.0510 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3750   -3.9440   -2.3560 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0740   -2.8370   -0.0710 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0880   -3.1950   -0.1520 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -3.1760    0.8840 O   0  5  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
    2.7210   -0.0750   -4.8150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2380    1.3020   -3.9830 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9950   -4.5150   -1.6710 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8140   -4.3370   -3.1270 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  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 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END