IBS-ZINC04981687 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.2760 1.3800 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 1.3450 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 3.2260 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 3.6010 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 5.1110 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 5.4700 -0.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 5.5200 -0.9400 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5680 6.2500 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 5.9390 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 6.1060 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 5.8180 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 5.8840 -2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 6.4820 -4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 6.1280 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 5.3900 -3.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8580 7.2140 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 8.1340 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 9.1460 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 9.2550 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9740 8.3460 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1990 7.3290 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2830 8.4570 -2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0210 9.5330 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 4.1590 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 4.0280 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 2.7810 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 1.6630 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 1.7920 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 3.0430 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 0.7000 -1.6340 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 0.2950 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 1.8370 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 1.7120 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 1.8570 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 0.2680 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.5900 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 3.7520 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 3.5090 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 3.3190 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 3.0760 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 5.3930 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 5.6370 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 6.5510 -4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 8.0520 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 9.8570 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0190 10.0500 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6330 6.6240 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5620 10.4810 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0480 9.5060 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0160 9.4310 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 4.9020 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0470 2.6800 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 0.6880 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 3.1460 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.7770 1.3280 N 0 0 0 0 0 0 0 0 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 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 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 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 54 1 0 0 0 0 M END