D0I3TU Wcorina 11010620263D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 50 53 0 1 0 999 V2000 -0.0167 1.3837 0.0096 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 1.1886 -0.6819 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1586 2.1026 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3782 1.4335 -0.0132 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3915 0.0264 -0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -0.3660 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6883 1.8538 -0.0239 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5248 0.7627 -0.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0342 0.8565 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4212 2.2854 -0.4548 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6256 3.2787 0.3968 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1529 3.2482 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3414 -1.7735 -0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5077 -2.2373 -1.4691 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9769 -3.4690 -1.7233 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2188 -1.5005 -2.3821 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1609 4.6281 0.2004 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7651 5.4749 1.4890 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1618 5.2286 -1.1359 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4816 5.0940 1.6048 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6819 6.8499 1.1401 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 4.9292 2.6499 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4074 5.8649 0.9268 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7539 5.5674 1.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1756 4.4967 1.7872 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2474 3.7252 2.4658 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9018 4.0279 2.3781 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4917 4.2046 1.8760 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9624 1.9054 0.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9283 -0.5526 0.0076 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1957 -1.7618 -0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1331 3.1822 0.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 0.6326 0.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4381 0.1497 -0.7799 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4879 2.4344 -0.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1918 2.4436 -1.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7097 3.0042 1.4483 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0487 3.6699 -1.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5603 3.8291 0.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3071 -1.7968 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6447 -2.4327 0.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0663 -3.7216 -2.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2301 5.7729 -1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0031 5.9158 -1.2249 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2527 4.4437 -1.8868 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0782 6.6998 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4770 6.1695 0.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5752 2.8898 3.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1776 3.4263 2.9073 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 6 2 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 14 1 0 0 0 0 7 9 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 18 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 2 0 0 0 0 19 23 2 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 21 28 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END $$$$