IBS-ZINC05348772 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.3020 1.2770 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.2470 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -0.6430 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.1770 2.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1740 0.9100 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.7870 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -0.3850 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -0.8210 0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.6360 3.7400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6800 -1.7250 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0820 4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.6490 6.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.2200 7.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.6020 8.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.3020 8.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.1690 9.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.5620 11.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -0.1540 12.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 0.6430 12.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 1.0370 10.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 0.6410 9.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.1260 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -1.0190 3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -0.5530 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 0.8080 3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 1.7010 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 1.2330 3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 1.2650 3.4620 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.7610 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 1.7150 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.5590 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 1.6430 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -1.7260 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -0.1700 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -1.8730 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.4160 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -0.8510 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 0.6990 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 1.0050 5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -0.3710 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.7380 6.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -0.2830 6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 0.3400 7.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -1.1860 11.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -0.4590 13.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 0.9590 13.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 1.6600 10.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 0.9530 8.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -2.0810 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -1.2510 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 2.7640 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 1.9290 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -0.3240 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.8470 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.4790 -2.1310 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 8 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 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 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 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