IBS-ZINC02246873 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 0.0010 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.0040 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -0.6970 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.0780 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.7710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.0720 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.6910 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 0.0680 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1690 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -4.2480 2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -6.2600 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -7.2440 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -8.5540 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -9.6460 1.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -9.5500 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -10.7120 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -10.6060 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 -9.3590 1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -8.2130 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -8.2820 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -7.1610 1.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -8.3240 1.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -6.9890 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -6.4400 0.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -9.3740 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -9.7300 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -10.8270 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -11.1600 -1.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -12.1800 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 1.8540 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 1.8740 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 1.8700 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.1570 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -2.6180 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -2.6080 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 0.2390 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.5110 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 1.0260 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -4.6510 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -11.6860 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -11.5020 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -9.3010 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 -7.2530 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -5.4760 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -7.0150 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -9.0170 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -10.2590 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -10.0880 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -8.8460 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -10.4700 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -11.7110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -12.3740 -3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -11.8510 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -13.0920 -1.5690 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 2 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END