D0W1QI Wcorina 11010620303D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 37 38 0 0 0 0 999 V2000 0.0526 1.8011 0.0710 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1442 0.0374 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6401 2.3055 -0.0224 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3577 -3.0161 0.8861 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9185 -2.0774 0.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3542 -0.5958 -0.1058 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9835 -0.6968 0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5206 0.1149 -0.3758 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5272 1.4879 -0.8745 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2801 -2.7200 0.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -1.9879 -0.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5558 2.1291 -1.1705 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4436 2.2388 1.3286 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9705 -3.9465 1.8879 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4123 -2.0798 1.0608 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7409 -3.9068 -0.4563 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0182 1.5123 -2.3172 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.7592 -3.2171 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4216 0.6575 -4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3305 1.5133 -3.2638 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3612 -4.4532 0.2919 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9607 3.0877 0.4534 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9179 -0.1932 0.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3723 -0.3239 -0.2246 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 1.8864 -0.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3428 -2.4953 -0.2641 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1808 -4.7658 -0.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5255 -3.5695 -1.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0403 1.0335 -2.3656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9342 2.5451 -2.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1636 -0.2420 -2.8185 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1757 1.6548 -4.9946 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1572 0.1999 -5.2916 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5201 0.0452 -4.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7425 1.5857 -2.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0299 0.9767 -3.9049 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1669 2.5145 -3.6624 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 12 2 0 0 0 0 1 13 2 0 0 0 0 2 6 2 0 0 0 0 2 7 1 0 0 0 0 3 9 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 14 2 0 0 0 0 4 15 2 0 0 0 0 4 16 1 0 0 0 0 5 7 2 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 17 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 M END $$$$