MDPI-ZINC03845997
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 31 31  0  0  1  0  0  0  0  0999 V2000
   -0.2280    1.6740    0.1390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2170    0.1540   -0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6330   -0.4990    1.0750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1240   -1.8070    1.4150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6090   -1.3770    1.3160 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.9210   -0.8700    2.2290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6430   -0.4050    0.1190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0520   -1.1520   -1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6250    0.7350    0.3970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4880   -2.5730    1.0520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0240   -3.5620    0.5250 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7890   -2.5440    1.4030 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3450   -0.2120   -1.4090 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7880    2.0560    0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8520    2.1230   -0.6330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6290    1.9240    1.1220 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6340   -0.7230    0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6830    0.1500    1.9490 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1020   -2.5850    0.6860 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1150   -2.1410    2.4240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3840   -1.9990   -1.3070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0760   -1.5120   -1.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9890   -0.4780   -2.0060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6050    1.4420   -0.4320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6310    0.3290    0.5030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3390    1.2440    1.3170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1600   -1.7530    1.8250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3540   -3.3140    1.2340 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3590    0.1770   -1.5020 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3610   -1.2970   -1.5190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2830    0.2220   -2.1860 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  4  5  1  0  0  0  0
  4 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
  8 23  1  0  0  0  0
  9 24  1  0  0  0  0
  9 25  1  0  0  0  0
  9 26  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 27  1  0  0  0  0
 12 28  1  0  0  0  0
 13 29  1  0  0  0  0
 13 30  1  0  0  0  0
 13 31  1  0  0  0  0
M  END