IBS-ZINC04817165 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -2.5110 2.9280 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 2.0010 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 0.6160 0.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -0.2090 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -0.9420 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 0.0850 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 0.8740 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 0.3650 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -0.9620 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -1.7610 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -1.2280 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -3.0430 2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -1.4930 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -1.3560 6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -1.7100 7.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -2.1350 7.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -1.5520 8.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -1.0850 8.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -0.9650 9.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.7440 7.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.8560 6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.5480 5.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.2440 7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -1.4000 7.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -1.8100 5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -2.8700 5.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -3.5220 6.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -3.1110 8.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -2.0470 8.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -4.5580 6.8720 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 3.9590 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 2.6510 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 2.8360 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 2.0930 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 2.2780 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -0.9370 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 0.4280 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -1.5780 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -1.5550 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.2140 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 1.8940 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 0.9820 4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -1.8330 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -3.1410 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -2.0050 4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -1.7800 9.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 0.4500 6.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 0.2710 8.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.3020 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -3.1900 4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -3.6180 9.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -1.7240 9.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END