NCID-ZINC01687473
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
   -0.1510    1.4100    0.3670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1500   -0.0870    0.0550 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.4250   -0.5900    0.8440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5790   -0.6720    0.0120 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.1320   -0.3810    0.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4050   -2.2170    0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7910   -2.8140   -1.0130 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3630   -0.2370   -1.1540 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1060    0.9040   -1.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2600    1.7420   -0.3520 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4910   -0.2910   -1.2160 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9000   -0.4400   -1.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8700    1.7670    0.5410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5360    1.9940   -0.4750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7400    1.6320    1.2610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3220   -0.8980   -1.9280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5930    1.0000   -2.2150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3590    0.4520   -0.6780 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1480   -1.3220   -0.5150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3040   -0.5810   -2.1190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9320   -2.6960    1.1100 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