NCID-ZINC01699832
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  0  0  0  0  0  0999 V2000
   -0.2600    1.7290   -0.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0370    0.0280    0.0900 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.8920   -0.0130    1.2590 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2310   -0.6720    0.0520 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8970   -0.3600   -1.2430 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3170   -0.4250   -1.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8830   -0.5800   -2.5650 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4060   -0.6350   -2.5510 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1080   -0.7520   -4.1850 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5480   -1.9970   -4.7060 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6370    0.4660   -4.8420 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6970    2.2480   -0.4070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8030    1.7710   -1.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8610    2.1740    0.4680 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7000    0.4940   -0.7020 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5990   -1.2800   -0.5360 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4690   -1.4850   -3.0280 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5320    0.2520   -3.1880 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8220    0.2680   -2.0900 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7570   -1.5040   -1.9850 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5460   -0.7890   -3.9240 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  2  0  0  0  0
  9 21  1  0  0  0  0
M  CHG  1  21  -1
M  END