D02XCE
 Wcorina  10100417253D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 15 14  0     1  0  0  0  0  0999 V2000
   -0.0172    1.4168    0.0098 S   0  0  3  0  0  0  0  0  0  0  0  0
    3.7882    4.1328    1.1329 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5718    4.4812   -1.0385 O   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
    0.9534    4.0611   -1.1847 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6639    3.5745    0.0054 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6846    2.0446   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0777    4.0961   -0.0053 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1537    3.9260    0.9022 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2118    1.6835    0.8800 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1948    1.6931   -0.8998 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4073    3.7483   -2.0299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0150    3.7784   -1.1685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4609    1.7201   -1.2231 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6906    4.4756    1.0763 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  2  0  0  0  0
  1  7  1  0  0  0  0
  1 14  1  0  0  0  0
  2  8  1  0  0  0  0
  2 15  1  0  0  0  0
  3  8  2  0  0  0  0
  6  5  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
M  END

$$$$