D01NTR Wcorina 11010620303D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 73 77 0 0 0 999 V2000 -0.0218 1.7578 0.0117 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1986 -0.0725 2.1124 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0137 0.9479 2.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6891 2.1756 -0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5187 1.7545 1.0338 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8742 2.1104 1.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3736 2.8604 -0.0337 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5407 3.2676 -1.0611 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2008 2.9254 -1.0422 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 -0.7038 1.0368 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 -0.5861 -0.6786 -1.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5859 -2.0565 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0129 -2.7763 -0.0582 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 -2.0980 1.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4051 1.2716 3.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0186 -4.2546 -0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5404 -4.8793 0.8137 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5548 -4.9094 -1.1181 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5491 -6.3741 -1.1486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -6.8606 -2.4136 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -8.3903 -2.4455 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9346 -8.8574 -3.6601 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7447 -10.3019 -3.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3626 -8.5140 -3.6275 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4149 2.0649 1.3423 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4672 -10.7502 -5.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2693 -12.2547 -5.3154 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7756 -12.5603 -5.4428 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -12.1120 -4.1708 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2509 -10.6075 -3.9752 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8653 -0.6390 3.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 0.0492 3.9702 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6158 -0.4512 3.6912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7386 0.1794 4.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6038 1.3109 4.9764 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3448 1.8123 5.2561 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2216 1.1776 4.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1748 3.2339 6.2379 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5289 1.7960 1.8072 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4189 3.1317 -0.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 3.8529 -1.8776 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5524 3.2460 -1.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0488 -0.1204 -1.8558 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0468 -2.5765 -1.9208 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0673 -2.6536 1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9712 -4.4109 -1.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4799 -6.7335 -1.1484 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0682 -6.7578 -0.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -6.5012 -2.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7399 -6.4769 -3.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -8.7497 -2.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7721 -8.7740 -1.5672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1531 -10.8366 -2.9903 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4746 -7.4320 -3.5581 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -8.8713 -4.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8296 -8.9840 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5314 -10.5325 -5.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0588 -10.2155 -5.9774 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6778 -12.7894 -4.4579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7841 -12.5741 -6.2215 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6346 -13.6322 -5.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3672 -12.0256 -6.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4615 -12.6467 -3.3133 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0111 -12.3298 -4.2615 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1575 -10.0728 -4.8328 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2639 -10.2881 -3.0691 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6656 -1.7053 3.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7019 -0.4920 4.1047 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7217 -1.3350 3.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7212 -0.2120 3.9761 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 1.8038 5.3689 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 1.5685 4.9749 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 4 1 0 0 0 0 1 26 2 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 10 1 0 0 0 0 3 5 1 0 0 0 0 3 16 2 0 0 0 0 4 9 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 24 31 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 33 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 34 2 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 34 70 1 0 0 0 0 35 36 2 0 0 0 0 35 71 1 0 0 0 0 36 37 1 0 0 0 0 36 72 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 38 73 1 0 0 0 0 M END $$$$