PUBCHEM-ZINC05962826
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
    0.7990   -0.3770   -1.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.0050    0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0260    1.5170    0.3030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4320   -0.5280    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4170   -2.0580    0.0030 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.7610   -2.4100   -0.7920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8140   -2.5720   -0.2340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4820   -2.9560    0.6960 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9270   -2.5500    1.2970 N   0  5  0  0  0  0  0  0  0  0  0  0
   -1.5200   -2.2370    2.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8190   -0.0050   -1.0050 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8170   -1.4610   -1.2120 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3310    0.0700   -1.9790 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4680   -0.4520    1.0250 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9850    1.8800    0.4880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4130    1.9690   -0.6100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6670    1.7860    1.1420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0290   -0.1750    0.8540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8650   -0.1630   -0.9190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3160   -2.6020   -1.4780 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2160   -2.9400   -1.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 14  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  3 17  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  9  1  0  0  0  0
  7  8  2  0  0  0  0
  7 20  1  0  0  0  0
  9 10  1  0  0  0  0
 20 21  1  0  0  0  0
M  CHG  1   9  -1
M  END