IBS-ZINC01000415 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 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 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0660 -1.2160 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 -4.2530 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.8680 1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.9520 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -6.3040 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.9810 -2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -8.3780 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -9.0680 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -10.4490 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -11.1450 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -10.4620 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -9.0810 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -12.9070 -2.4750 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -13.3220 -1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -13.3090 -3.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -13.3750 -2.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -13.0910 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -13.4810 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -13.1740 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -12.5250 0.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -12.1700 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -12.4370 -0.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -11.4340 1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 -13.5730 -0.2670 C 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 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5970 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -4.4070 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -6.8500 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -6.4920 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -8.5250 -4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -10.9850 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -11.0080 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -8.5480 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -13.8490 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 -14.0100 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -10.3600 1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -11.6720 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -11.7360 2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -12.7740 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -13.7500 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -14.4850 -0.8470 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END