D0IU2K
 Wcorina  10100417253D 1   1.00000     0.00000 
CORINA evaluation license 3.40 0067  02.08.2006
 59 60  0     1  0  0  0  0  0999 V2000
   -1.4906   -7.0051    0.8411 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6893   -8.2761   -0.1533 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1689  -12.5158   -1.9341 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0164    1.3548    0.0095 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8923  -14.7357    1.0711 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1922   -6.8762   -1.3535 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1966  -10.2829   -0.9608 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0245   -4.4344    1.2533 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7312  -12.9077   -0.4085 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2572  -16.2668   -0.4924 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1555   -8.3207   -1.6245 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9287   -8.4968   -3.1408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2855   -7.1470   -3.5550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0256   -6.1519   -2.6267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3569   -6.3082   -0.1424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0235   -8.9571   -0.8598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3747   -4.8071   -0.0103 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0605   -4.2770   -0.0215 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2970  -10.9015   -0.2173 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0396   -2.7702   -0.0132 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8299  -11.2356    1.2008 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7268  -12.1658   -0.9157 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0417   -2.0865    1.1886 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0241   -2.0736   -1.2075 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1490  -14.1369   -1.0873 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0230   -0.7053    1.1989 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0053   -0.6923   -1.2026 C   0  0  0  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
    4.1542  -13.7946   -2.1889 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7925  -15.0669   -0.0914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1028   -8.7763   -1.3360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2469   -9.3247   -3.3352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8766   -8.6470   -3.6576 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7857   -7.1465   -3.3535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4842   -6.9249   -4.6035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9979   -5.8933   -3.0461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4253   -5.2546   -2.4769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9279   -4.3755   -0.8445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3736  -10.8275   -1.5258 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5880   -4.6379    0.8615 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5706   -4.6284   -0.9184 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1375  -10.2091   -0.1694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5301   -4.8227    2.0425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1068   -3.4321    1.3357 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6487  -11.6959    1.7540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5190  -10.3211    1.7059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0106  -11.9280    1.1529 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0576   -2.6329    2.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0270   -2.6098   -2.1449 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1774  -12.6279    0.4061 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2784  -14.6225   -1.5280 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0242   -0.1717    2.1379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0064   -0.1486   -2.1357 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0249  -13.3090   -1.7481 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4651  -14.7091   -2.6940 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6888  -13.1219   -2.9092 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8616    1.7601    0.0033 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6714  -16.8654    0.1487 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1774  -16.5317   -1.4221 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  2  0  0  0  0
  2 16  2  0  0  0  0
  3 22  2  0  0  0  0
  4 28  1  0  0  0  0
  4 57  1  0  0  0  0
  5 30  2  0  0  0  0
  6 11  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  7 16  1  0  0  0  0
 19  7  1  0  0  0  0
  7 39  1  0  0  0  0
 17  8  1  0  0  0  0
  8 43  1  0  0  0  0
  8 44  1  0  0  0  0
  9 22  1  0  0  0  0
 25  9  1  0  0  0  0
  9 50  1  0  0  0  0
 10 30  1  0  0  0  0
 10 58  1  0  0  0  0
 10 59  1  0  0  0  0
 11 12  1  0  0  0  0
 11 16  1  0  0  0  0
 11 31  1  0  0  0  0
 12 13  1  0  0  0  0
 12 32  1  0  0  0  0
 12 33  1  0  0  0  0
 13 14  1  0  0  0  0
 13 34  1  0  0  0  0
 13 35  1  0  0  0  0
 14 36  1  0  0  0  0
 14 37  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 38  1  0  0  0  0
 18 20  1  0  0  0  0
 18 40  1  0  0  0  0
 18 41  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 19 42  1  0  0  0  0
 20 23  2  0  0  0  0
 20 24  1  0  0  0  0
 21 45  1  0  0  0  0
 21 46  1  0  0  0  0
 21 47  1  0  0  0  0
 23 26  1  0  0  0  0
 23 48  1  0  0  0  0
 24 27  2  0  0  0  0
 24 49  1  0  0  0  0
 25 29  1  0  0  0  0
 25 30  1  0  0  0  0
 25 51  1  0  0  0  0
 26 28  2  0  0  0  0
 26 52  1  0  0  0  0
 27 28  1  0  0  0  0
 27 53  1  0  0  0  0
 29 54  1  0  0  0  0
 29 55  1  0  0  0  0
 29 56  1  0  0  0  0
M  END

$$$$