PUBCHEM-ZINC06707781
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 31 31  0  0  1  0  0  0  0  0999 V2000
    0.4750    0.7840    0.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3500   -0.5610   -0.1620 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2190   -1.0770   -0.8510 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8690   -1.0950    0.1150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570   -2.4350   -0.3610 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1530   -3.0300   -0.1890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2430   -3.0030    0.4090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5530   -2.6710    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6700   -3.1950    0.6640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5180   -4.0550    1.7470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250   -4.3620    2.1760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0790   -3.8350    1.5410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7300   -4.1770    2.1310 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1460   -3.2580    2.1490 O   0  5  0  0  0  0  0  0  0  0  0  0
   -5.6220   -4.5850    2.3920 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2810   -2.4630   -1.8790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5130   -1.4810   -2.5770 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2050   -3.7460   -2.3450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4020   -3.8780   -3.7530 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4680    1.1940    0.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2760    1.4640    0.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3560    0.6860    1.5680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7210   -1.9930   -0.8270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6620   -2.9230    0.3160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0870   -5.0170    3.0350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5560   -4.3570    2.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4960   -5.2110    3.1760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4030   -3.5370   -4.0330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6340   -3.3210   -4.3000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3110   -4.9360   -4.0110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5870   -5.3550    2.5820 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  2  0  0  0  0
  8  9  2  0  0  0  0
  8 23  1  0  0  0  0
  9 10  1  0  0  0  0
  9 24  1  0  0  0  0
 10 11  2  0  0  0  0
 10 15  1  0  0  0  0
 11 12  1  0  0  0  0
 11 25  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 31  2  0  0  0  0
 15 26  1  0  0  0  0
 15 27  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 28  1  0  0  0  0
 19 29  1  0  0  0  0
 19 30  1  0  0  0  0
M  CHG  1  14  -1
M  END