PUBCHEM-ZINC04127811
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 23 23  0  0  0  0  0  0  0  0999 V2000
   -0.0190    1.5260    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
    0.6710   -0.4650   -1.1740 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7770   -1.8100   -1.3360 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2480   -2.6690   -0.3840 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3560   -4.0360   -0.5510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9920   -4.5480   -1.6670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5200   -3.6940   -2.6180 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4090   -2.3270   -2.4580 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9690   -1.4140   -3.4790 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.1210   -1.0280   -3.3850 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2790   -1.0480   -4.4140 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.2000   -4.2460   -3.8110 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2940   -5.4520   -3.9550 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6660   -3.4950   -4.6490 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0040    1.9030    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8870   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8770    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5290   -0.3650    0.8850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0200   -0.3810    0.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2480   -2.2690    0.4880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0550   -4.7050    0.1900 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0760   -5.6170   -1.7960 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  1  0  0  0  0
  2 19  1  0  0  0  0
  2 20  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5 21  1  0  0  0  0
  6  7  2  0  0  0  0
  6 22  1  0  0  0  0
  7  8  1  0  0  0  0
  7 23  1  0  0  0  0
  8  9  2  0  0  0  0
  8 13  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  CHG  1  13   1
M  CHG  1  15  -1
M  END