D03CHA Wcorina 11010620303D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 59 62 0 1 0 999 V2000 -0.0168 1.3848 0.0097 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 1.2081 -0.6772 -0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3974 0.0302 -0.0207 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3829 1.4143 -0.0126 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0936 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 2.0682 0.0191 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2485 3.1417 0.6559 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0262 2.3892 1.2173 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8953 2.5621 -1.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0093 3.1650 -0.8369 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4575 1.1282 1.9208 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8986 3.7738 -1.8257 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5799 3.7326 -3.1346 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9266 4.3177 -1.4664 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 2.3867 0.9806 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4683 1.0769 3.3022 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8693 -0.0775 3.9481 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2599 -1.1817 3.2117 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2488 -1.1297 1.8292 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8476 0.0251 1.1845 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7631 -2.6321 4.0222 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1621 3.8295 0.0127 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9108 -0.8200 -0.0397 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.4106 4.3011 -4.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7202 5.3600 -4.8055 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7166 6.0699 -5.7248 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3267 5.0514 -6.6917 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9975 3.9343 -5.8876 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 3.2862 -4.9636 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1228 6.3703 -3.8241 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6346 2.1824 -4.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9255 -0.5572 0.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2229 -1.7571 -0.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3127 1.9637 -0.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2894 4.1554 1.0544 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 3.0301 1.8914 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7608 3.2991 -3.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6449 2.2965 2.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3912 2.9330 0.5764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5003 1.3926 0.5352 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1631 1.9388 3.8769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8773 -0.1176 5.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5533 -1.9915 1.2539 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 0.0658 0.1053 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9226 4.9206 -5.4046 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5071 6.5213 -5.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2006 6.8454 -6.2909 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0688 5.5444 -7.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5415 4.6282 -7.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8082 4.3521 -5.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3967 3.1840 -6.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1606 2.8566 -5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4124 5.8650 -3.1698 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6103 7.1563 -4.3788 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9201 6.8095 -3.2244 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4378 2.6118 -3.5445 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0454 1.4290 -4.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8984 1.7201 -3.4858 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 16 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 36 1 0 0 0 0 9 12 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 11 13 1 0 0 0 0 12 17 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 25 1 0 0 0 0 14 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 32 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END $$$$