PUBCHEM-ZINC06425479
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 27 26  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5260    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.0200   -0.3810    0.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7070   -0.4900   -1.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0230   -1.1880   -2.1780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2910   -1.4480   -2.0030 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6550   -1.6240   -3.2890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1270   -2.3530   -4.2370 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7540   -2.7600   -5.4200 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.6200   -3.3120   -5.0550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0390   -3.6330   -6.3590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5190   -3.1600   -7.3620 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0260   -0.2300   -1.4140 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0310   -0.0310   -1.5480 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6930   -0.4770    1.1600 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0040    1.9030    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8870   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8770    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6920   -1.9510   -2.7250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5340   -3.2460   -3.7620 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9450   -1.7260   -4.5920 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4200   -1.0280   -6.4800 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2940   -0.2020    1.9960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2110   -4.9350   -6.0820 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2050   -1.5570   -6.1320 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7920   -0.9870   -5.5420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7260   -5.4540   -6.7140 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  4  1  0  0  0  0
  2 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 25  1  0  0  0  0
 11 12  2  0  0  0  0
 11 24  1  0  0  0  0
 13 14  3  0  0  0  0
 15 23  1  0  0  0  0
 22 25  1  0  0  0  0
 24 27  1  0  0  0  0
 25 26  1  0  0  0  0
M  CHG  1  13   1
M  END