NCID-ZINC01653005
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  0  0  0  0  0  0999 V2000
   -0.0630    1.5910    0.1320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0240    0.0870   -0.0470 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1280   -0.6140   -0.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    0.1970   -0.1970 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9820    0.3740    0.9510 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.1280   -1.9940   -0.3690 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2450   -2.8000   -0.5360 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4190   -2.4520   -0.5710 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8630   -4.2510   -0.6850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4150   -0.5030   -0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9160    2.0760    0.1220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6540    2.0460   -0.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5340    1.8400    1.0890 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2330   -2.4610   -0.3670 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400   -4.3810   -1.5750 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7640   -4.8620   -0.7910 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3120   -4.5840    0.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0150   -0.0730   -0.8330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4540   -1.5870   -0.1410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9040   -0.2670    0.9270 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8340    0.6410   -1.3290 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 10  1  0  0  0  0
  3  4  1  0  0  0  0
  3  6  1  0  0  0  0
  4  5  1  0  0  0  0
  4 21  2  0  0  0  0
  6  7  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
M  CHG  1   5  -1
M  END