NCID-ZINC01687472
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
    0.3130    1.3840    0.1870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360   -0.0960   -0.0770 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3740   -0.6600    0.8020 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7790   -0.6110   -1.3300 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8400   -0.3350   -1.2790 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6880   -2.1630   -1.2680 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0150   -2.6940   -2.2040 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2400   -0.0900   -2.5950 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5960    1.0870   -3.1850 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4240    1.8920   -2.7800 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3810   -0.2740   -0.2510 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0690   -0.4930    0.9710 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3870    1.5940    0.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1720    2.0220   -0.5580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0970    1.6850    1.1570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4370   -0.7170   -3.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0420    1.2490   -4.1240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7150   -1.4110    1.4500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9480    0.3570    1.6490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1340   -0.6090    0.7490 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3180   -2.7100   -0.3170 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  1  0  0  0  0
  6  7  2  0  0  0  0
  6 21  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  1  0  0  0  0
  9 10  2  0  0  0  0
  9 17  1  0  0  0  0
 11 12  1  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
 12 20  1  0  0  0  0
M  CHG  1  21  -1
M  END