IBS-ZINC02308966 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.9620 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -4.5610 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -4.1030 1.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -2.6420 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 -1.9870 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1020 -4.7290 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -4.4400 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1390 -5.1050 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7680 -4.6170 3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9770 -4.8990 4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2940 -4.2600 5.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4110 -3.3390 6.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 -3.0530 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -3.6870 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 -3.5950 3.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 -3.0200 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4710 -4.5330 6.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7360 -3.8360 7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4920 -5.9790 1.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7000 -6.2180 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5370 -5.6100 0.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -2.1000 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.2900 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -4.2940 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -4.2400 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -5.6490 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -2.3300 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -2.3370 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -2.2880 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -0.9020 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6620 -5.6140 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6660 -2.8430 7.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5390 -2.3350 6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9580 -4.0700 8.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7460 -2.7630 7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7050 -4.1450 7.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0140 -6.9310 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 27 2 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 23 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 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 M END