NCID-ZINC01714115
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  0  0  0  0  0  0999 V2000
    0.0980    1.6990   -1.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3490    0.5620    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0150    1.2010    1.2600 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7160    0.1500   -0.2660 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8440   -1.1640   -0.1370 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4390   -0.5840    0.5130 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5220   -1.6450    0.3260 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8600   -1.1440    0.8670 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1910   -2.3050    0.6330 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.7520   -3.4860    1.3730 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2540   -2.4670   -0.8180 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1430    1.9850   -1.1600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0560    1.2140   -2.2520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5420    2.5790   -1.2030 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7200    0.3340   -0.0130 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3200   -0.3470    1.5750 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2410   -2.5700    0.8440 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6250   -1.8920   -0.7380 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1570   -0.2160    0.3640 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7920   -0.9460    1.9420 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3350   -1.6080    1.2190 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