PUBCHEM-ZINC06425619
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 30 31  0  0  1  0  0  0  0  0999 V2000
    0.0840    1.2680    0.5930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1610    0.0560   -0.2960 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3010    0.2100   -1.2780 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4870   -1.1840    0.3890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3540   -2.0780    0.7220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5950   -0.1670   -0.5070 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4060    0.5990   -1.3030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0910    1.5820   -1.9590 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8370    0.1060   -1.3580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5990    0.5270   -0.4910 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2370   -0.8470   -2.3840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4510   -1.2770   -3.4370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1690   -2.1810   -4.1730 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8330   -2.6540   -5.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4160   -2.3580   -3.6230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4900   -1.5320   -2.5000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6820   -1.5340   -1.7440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7450   -2.3570   -2.1320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6360   -3.1700   -3.2570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4700   -3.1850   -4.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1550    1.4510    0.7340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3540    2.1720    0.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3640    1.1280    1.5840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9400   -0.9880   -0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4390   -1.0200   -3.7280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7740   -0.9070   -0.8610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6610   -2.3620   -1.5470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4710   -3.8050   -3.5410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3920   -3.8210   -4.9030 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7420   -1.1570    0.5160 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  1 23  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  4  5  2  0  0  0  0
  4 30  1  0  0  0  0
  6  7  1  0  0  0  0
  6 24  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12 13  1  0  0  0  0
 12 25  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 20  2  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 26  1  0  0  0  0
 18 19  2  0  0  0  0
 18 27  1  0  0  0  0
 19 20  1  0  0  0  0
 19 28  1  0  0  0  0
 20 29  1  0  0  0  0
M  CHG  1  30  -1
M  END