IBS-ZINC02436516 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0280 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -4.7450 -3.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -6.0690 -3.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -6.7080 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -6.0560 -1.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -3.8830 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -4.7290 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -4.0660 -1.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -8.0950 -2.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -8.7820 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -10.1130 -1.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -10.8220 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -10.1410 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -10.8220 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -10.1080 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 -8.7110 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -8.0220 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -8.7220 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 -8.0910 -1.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7260 -10.7660 0.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7530 -9.9660 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8300 -10.8760 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -12.3280 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -4.0290 -3.7650 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -8.5840 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -11.9020 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -8.1690 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -6.9420 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 -9.3270 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 -9.3470 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 -10.2650 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -11.5150 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2590 -11.4950 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -12.6800 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -12.7250 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -12.6690 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -3.8450 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -4.6460 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -3.0800 -3.2570 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 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 12 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END