D01JIA
 Wcorina  11010620243D 1   1.00000     0.00000     0
CORINA evaluation license 3.40 0067  02.08.2006
 20 19  0     1  0            999 V2000
   -0.0143    1.2041    0.0087 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1155    3.8224   -2.8071 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2804    1.9752    0.0004 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3972    3.4859   -3.7245 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5768    2.4591   -1.4205 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8235    3.3459   -1.4076 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1748    4.6226   -3.0393 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1858    1.8593    0.0178 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3715    1.1052    0.4591 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1960    2.8340    0.6665 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7490    1.5996   -2.0684 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7277    3.0314   -1.7940 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6727    2.7736   -1.0341 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6513    4.2053   -0.7596 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7494    4.8918   -2.3055 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3628    4.9294   -3.9401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9895    1.3217    0.0187 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2313    0.8243    1.4180 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4701    0.3011   -0.1425 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  9  1  0  0  0  0
  2  7  1  0  0  0  0
  2  5  2  0  0  0  0
  2  8  1  0  0  0  0
  4  6  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
M  END

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