PUBCHEM-ZINC04583111
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 25 25  0  0  0  0  0  0  0  0999 V2000
   -0.0120    1.4930    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0180   -0.0130    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0500   -0.7160    1.1910 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0770   -2.0980    1.1780 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0710   -2.7820   -0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0380   -2.0860   -1.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0060   -0.6970   -1.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0330    0.0110   -2.4130 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5300   -0.5720   -3.5220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0370   -1.6740   -3.4530 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4640    0.0660   -4.7050 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0190   -0.6230   -5.8570 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1120   -2.8470    2.4540 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1180   -2.2460    3.5140 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1360   -4.0650    2.4450 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0080    1.8770    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5470    1.8550   -0.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5190    1.8380    0.9170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0550   -0.1840    2.1310 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0920   -3.8620   -0.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0340   -2.6200   -2.1540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2980    0.9220   -2.4510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4940   -1.5670   -6.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0780   -0.8180   -5.6880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9010    0.0000   -6.7440 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
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  2  0  0  0  0
  5 20  1  0  0  0  0
  6  7  1  0  0  0  0
  6 21  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 22  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 23  1  0  0  0  0
 12 24  1  0  0  0  0
 12 25  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1  13   1
M  CHG  1  15  -1
M  END