IBS-ZINC04813400 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.8570 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.9920 -1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4710 -5.3440 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -6.8320 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -7.4660 -2.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -7.3770 -1.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -6.3510 -1.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9940 -6.4730 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -6.4490 -2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -6.2220 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -6.3120 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -6.6280 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -6.8530 -4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -6.7600 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -6.7260 -4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -5.7080 -5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 -8.1370 -5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -8.8180 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -9.3530 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -10.0180 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -4.5720 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5950 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -5.9760 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -6.1350 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -7.1000 -5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -6.9320 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -6.5180 -4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -5.9170 -6.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 -5.7800 -6.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -4.7040 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -8.8620 -4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -8.2080 -6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -8.3450 -5.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -9.0020 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -9.3190 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -9.1890 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -10.4010 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -10.1820 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -4.4000 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 29 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END