IBS-ZINC05219303 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.6560 -1.5520 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -1.3710 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.7670 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -0.8200 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -0.3890 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.5670 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -1.1990 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.6340 -2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -1.4400 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -1.7630 -0.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.2140 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -0.9300 3.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 1.2670 2.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5660 1.5880 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 2.1950 4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 2.5750 5.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 2.2660 4.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 1.7280 3.8220 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2410 0.8810 4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 2.7980 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 4.1280 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 5.1100 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 4.7640 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 3.4350 2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 2.4490 2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 1.1490 2.5290 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 2.8150 6.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 1.6970 7.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 1.2640 9.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 2.7100 8.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 1.3900 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -0.7130 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -2.4800 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -1.5950 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 0.1000 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -0.2200 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -1.3410 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.1220 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 4.4000 4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 6.1500 3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 5.5320 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 3.1640 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 3.2480 6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 3.5870 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 1.2640 7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 0.9250 6.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 0.3750 9.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 0.9900 9.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 1.6970 10.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 3.4880 7.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 1.8740 8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 3.1130 9.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 1.8200 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 2.2470 8.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 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 29 54 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 30 54 1 0 0 0 0 M END