NCID-ZINC01693143
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.5030    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0230   -0.7180    1.1650 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0410   -2.0450    1.1480 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0400   -2.7360    0.0640 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0210   -2.1440   -1.1370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0050   -0.7280   -1.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0320   -0.0940   -2.4560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0390   -0.8480   -3.5910 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0190   -2.2400   -3.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0200   -2.8870   -2.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0610   -4.1490    0.1410 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0040    1.8800    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8640   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8540    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0250   -0.1970    2.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0480    0.9840   -2.5190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0600   -0.3610   -4.5540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0250   -2.8140   -4.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360   -3.9670   -2.2940 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  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  2  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  2  0  0  0  0
  9 18  1  0  0  0  0
 10 11  1  0  0  0  0
 10 19  1  0  0  0  0
 11 20  1  0  0  0  0
M  CHG  1   5   1
M  CHG  1  12  -1
M  END