MDPI-ZINC01757885
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0730    1.5020    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0240   -0.0050    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1010   -0.7010    1.1890 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1450   -2.0840    1.1810 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0650   -2.7780   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0600   -2.0940   -1.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1110   -0.6990   -1.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2500    0.0400   -2.4750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1810    1.2530   -2.4840 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2800   -2.8240    2.4550 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.3510   -2.2160    3.5080 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3190   -4.0420    2.4510 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9220    1.8990   -0.1870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7660    1.8480   -0.7510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4100    1.8470    0.9930 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1640   -0.1660    2.1250 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1000   -3.8570   -0.0130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1220   -2.6370   -2.1370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4550   -0.6310   -3.6250 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5400   -0.1040   -4.4320 H   0  0  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  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 16  1  0  0  0  0
  4  5  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  2  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 19  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END