IBS-ZINC02199988 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 0.8500 -0.0920 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.5000 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -1.6780 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.8020 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.0440 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -0.3030 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -1.3190 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -2.1010 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -1.8380 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -1.5950 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -1.9770 -1.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 -1.4100 1.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4790 -1.8530 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 -0.7710 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 0.2560 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -0.8180 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9540 0.7100 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7430 0.8890 5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7740 1.6980 5.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9040 3.0500 5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1830 3.6730 4.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0170 3.7040 6.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2630 5.0570 6.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3210 5.6200 6.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0840 4.8220 7.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7600 3.4790 7.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7430 2.8910 7.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 0.2060 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 0.7580 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -0.9100 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 0.3530 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -2.5620 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -1.9620 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -1.4140 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 0.7520 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 0.2850 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -2.9140 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.4530 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7970 -2.1710 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5270 -2.7350 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4480 0.1040 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4420 -1.1730 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 0.5580 3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 1.1320 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 -1.6380 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -0.3690 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9580 0.3090 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8480 1.6460 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 -0.0810 5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7820 1.3710 5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4440 1.3020 6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6550 5.6620 5.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5500 6.6770 6.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9130 5.2410 8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3300 2.8230 8.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9680 -0.2890 3.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9570 -1.1140 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 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 9 2 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 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 56 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END