IBS-ZINC06759810 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.1300 1.8350 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.3150 0.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5390 -0.0850 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.3170 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -1.3310 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -1.9180 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -1.5160 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -0.5110 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 0.0820 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -0.0770 1.8200 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.3650 -2.1340 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 -2.6290 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3390 -3.2210 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9030 -3.3270 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2130 -2.8420 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -2.2510 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.0170 1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.2260 2.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -0.0230 1.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -0.2890 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -0.2020 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 0.0170 1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -0.3950 3.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 -0.3610 3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -0.6070 4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -0.7950 5.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 2.2520 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 2.1060 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 2.3300 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -1.6770 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -2.7070 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.8500 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -2.5620 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8760 -3.5970 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -3.7850 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 -2.9190 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 -1.8690 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 0.1620 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 0.4550 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -1.2910 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 -0.5770 4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 -1.1290 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 0.6200 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 -0.5900 4.4390 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 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 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 44 -1 M END