PUBCHEM-ZINC03995564
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 31 31  0  0  1  0  0  0  0  0999 V2000
    1.1860    1.2770    0.9730 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8360    0.0280    0.1530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0660    0.2590   -0.4260 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9820   -0.2510   -0.8280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5670   -1.1900    1.0630 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.5070   -1.3980    1.5990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4990   -0.9510    2.1410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4070   -3.3110    1.5530 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.1130   -4.0870    1.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1490   -2.5130    0.3710 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0430   -3.0010   -0.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8710   -2.3890   -0.7890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3020   -1.8570   -0.5870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7670   -1.9930    0.5910 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6030   -3.9970    2.5140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2570   -3.9020    3.7330 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0600    1.1020    1.6080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4110    2.1230    0.3140 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3540    1.5810    1.6150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9130   -0.4700   -0.2950 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7630   -1.1000   -1.4810 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1590    0.6170   -1.4720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0540   -0.7300    3.1160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2330   -0.1830    1.8820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4160   -1.8050   -1.5970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0080   -3.3980   -1.2050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2270   -2.2410    2.2560 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.4100   -2.5610    3.2180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1410   -2.1530    1.6710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8360   -1.3450   -1.6050 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.6100   -4.5350    1.9860 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  4 20  1  0  0  0  0
  4 21  1  0  0  0  0
  4 22  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  7 23  1  0  0  0  0
  7 24  1  0  0  0  0
  7 27  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 15  1  0  0  0  0
  8 27  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  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 30  1  0  0  0  0
 15 16  2  0  0  0  0
 15 31  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
M  CHG  1  27   1
M  CHG  1  30  -1
M  CHG  1  31  -1
M  END