D0EG8X
 Wcorina  10100417263D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 20 19  0     1  0  0  0  0  0999 V2000
   -0.0225    1.8097    0.0120 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5081   -2.6830    1.5194 P   0  3  0  0  0  0  0  0  0  0  0  0
    0.0145   -4.3197    1.5997 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2450   -1.7751    2.6368 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7907   -2.5720    0.0149 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4333   -0.5336    0.0129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4126   -2.0635    0.0045 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0021   -0.0041    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7392    2.2418   -0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9605   -0.1726   -0.8702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9435   -0.1821    0.9097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9024   -2.4150   -0.8923 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5123   -0.3556   -0.8948 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5293   -0.3651    0.8851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2852   -2.2596    0.8371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2812   -2.3045   -0.8254 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2229    1.8245    0.8807 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2059    1.8341   -0.8992 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8474    3.3264    0.0023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3642   -4.8177    2.3371 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  7  1  0  0  0  0
  3 20  1  0  0  0  0
  7  5  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
M  CHG  1   2   1
M  END

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