PUBCHEM-ZINC03157933
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 27 27  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.5030    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
    1.0600   -0.5960   -0.0110 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1560   -0.6940    0.0090 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1370   -2.0950    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2950   -2.7840    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3560   -2.1910    0.0220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2750   -4.2630    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4720   -4.9800    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4460   -6.3590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2370   -7.0320   -0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0470   -6.3260   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0580   -4.9470   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2420   -7.0540   -0.0380 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2540   -8.2720   -0.0440 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2910   -6.4350   -0.0440 O   0  5  0  0  0  0  0  0  0  0  0  0
   -4.7150   -7.1220    0.0080 N   0  3  0  0  0  0  0  0  0  0  0  0
   -5.7800   -6.5310    0.0220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6940   -8.3390    0.0010 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0040    1.8800    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8640   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8540    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0020   -0.2200    0.0200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2900   -2.5680   -0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4160   -4.4560    0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2220   -8.1110   -0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1280   -4.3980   -0.0310 H   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
  4 23  1  0  0  0  0
  5  6  1  0  0  0  0
  5 24  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 13  2  0  0  0  0
  9 10  2  0  0  0  0
  9 25  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  1  0  0  0  0
 11 12  2  0  0  0  0
 11 26  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 27  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
M  CHG  1  14   1
M  CHG  1  16  -1
M  CHG  1  17   1
M  CHG  1  19  -1
M  END