PUBCHEM-ZINC05161671
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3770    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2140   -0.6830   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4060    0.0290   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3830    1.4140   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1690    2.0870    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6990   -0.6910   -0.0360 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.2220   -0.9820   -1.0970 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2410   -0.9920    1.0130 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2330   -2.0800   -0.0200 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9600    1.9040    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260   -0.5560    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1510    3.1670    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4000   -2.5760   -0.0140 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0800   -2.5530   -0.0300 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5480    2.1140   -0.0200 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8770    2.3210   -0.9060 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 11  1  0  0  0  0
  2  3  2  0  0  0  0
  2 12  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6 13  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END