D0XB8P
 Wcorina  11010620243D 1   1.00000     0.00000     0
CORINA evaluation license 3.40 0067  02.08.2006
 20 19  0     0  0            999 V2000
    0.0557    1.3061   -0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9921    3.5458   -0.1091 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1002   -0.0313   -0.1088 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3215    2.1143   -0.1274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000    1.8622    0.1875 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3665    3.8880    1.1753 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2205    4.3331   -0.2805 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0601    3.8479   -1.2036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7374   -0.5067   -0.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9838    1.8832    0.7068 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8190    1.8680   -1.0654 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0036    3.5479    1.9917 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2381    4.9684    1.2405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063    3.4014    1.2466 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6847    4.0793   -1.2335 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9761    5.3953   -0.2669 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9120    4.1089    0.5316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9059    3.3879   -0.9957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0625    4.9277   -1.2888 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4572    3.4525   -2.1385 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
M  CHG  1   2   1
M  END

$$$$