PUBCHEM-ZINC05494307
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 28 28  0  0  0  0  0  0  0  0999 V2000
   -0.0560    1.4880   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0160   -0.0470   -0.0700 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4070   -0.6650    0.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4520   -2.2020    0.0880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3540   -2.8000   -0.0790 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3590    2.0770   -0.1120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3900    3.5850    0.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4930    4.2600    1.1830 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5970    5.6260    1.1630 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6100    6.4030    0.0410 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4930    5.7250   -1.1380 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3680    4.3620   -1.2510 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2480    3.8240   -2.3480 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7170    7.6250    0.0890 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4990    3.6460    2.3990 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6630    1.8620   -0.8660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.8150    0.8940 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4500   -0.3760   -1.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6190   -0.4130    0.7460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8830   -0.3030    0.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0300   -0.3330   -0.7840 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9870    1.6270    0.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8310    1.7710   -1.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4960    6.2680   -1.9890 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6750    6.1200    2.0410 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4120    2.6400    2.4740 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5850    4.1870    3.2470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6050   -2.6820    0.2860 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  1  0  0  0  0
  2 18  1  0  0  0  0
  2 19  1  0  0  0  0
  3  4  1  0  0  0  0
  3 20  1  0  0  0  0
  3 21  1  0  0  0  0
  4  5  2  0  0  0  0
  4 28  1  0  0  0  0
  6  7  1  0  0  0  0
  6 22  1  0  0  0  0
  6 23  1  0  0  0  0
  7  8  2  0  0  0  0
  7 12  1  0  0  0  0
  8  9  1  0  0  0  0
  8 15  1  0  0  0  0
  9 10  1  0  0  0  0
  9 25  1  0  0  0  0
 10 11  1  0  0  0  0
 10 14  2  0  0  0  0
 11 12  1  0  0  0  0
 11 24  1  0  0  0  0
 12 13  2  0  0  0  0
 15 26  1  0  0  0  0
 15 27  1  0  0  0  0
M  CHG  1  28  -1
M  END