PUBCHEM-ZINC05112924
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 32 31  0  0  1  0  0  0  0  0999 V2000
   -0.1470    1.7330   -1.1430 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1720    0.2680   -1.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0200   -0.7360   -0.3110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2780   -0.2180    0.8240 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7230    2.3410   -0.0290 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.7490    1.9600   -0.0710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7480    3.8630   -0.1470 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1230    4.5690    0.6400 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5160    4.3200   -1.1850 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6940    5.7220   -1.5930 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.7700    6.3420   -0.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5790    6.1940   -2.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7140    6.4400   -1.7840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8990    7.4060   -1.0520 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6900    5.5070   -2.0050 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5750    5.6230   -1.5290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5660    4.7120   -2.6170 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9870    5.8300   -2.4530 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4180    4.7000   -2.8480 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0100    2.2950   -2.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2100    1.8350   -0.8870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4600   -0.0570   -2.2830 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2130    0.1890   -1.7860 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0850    3.7000   -1.7710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8370    7.1430   -3.0130 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4150    5.4680   -3.3320 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1340   -1.9420   -0.6290 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4380    6.9910   -2.6430 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.1790    1.9420    1.3010 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8500    2.0430    2.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0890    0.8880    1.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6760    2.4580    1.5290 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  2  3  1  0  0  0  0
  2 22  1  0  0  0  0
  2 23  1  0  0  0  0
  3  4  2  0  0  0  0
  3 27  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 29  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 24  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 18  1  0  0  0  0
 12 13  1  0  0  0  0
 12 25  1  0  0  0  0
 12 26  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 18 19  2  0  0  0  0
 18 28  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
M  CHG  1  27  -1
M  CHG  1  28  -1
M  CHG  1  29   1
M  END