IBS-ZINC02398773 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4270 -4.6410 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -4.8090 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -6.3420 -0.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1860 -6.6760 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -6.8330 -1.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -6.0820 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -6.8290 -2.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -8.0590 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -8.1020 -1.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -9.1280 -3.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -9.0240 -3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -8.0240 -3.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -10.3520 -4.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -11.2510 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -10.3380 -3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -10.6520 -2.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.7520 -1.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -6.8700 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -7.6460 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -8.1300 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0850 -7.8380 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -7.0600 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 -6.5730 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 -8.3110 -2.1020 F 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -4.4270 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -4.4770 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -10.2480 -5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -10.7510 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -11.5950 -4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -12.0980 -3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -4.1690 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -7.8740 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -8.7370 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -6.8320 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -5.9630 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 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 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 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 22 45 1 0 0 0 0 23 24 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 M END