IBS-ZINC02335055 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.7330 0.9670 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -0.4550 -0.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -0.9780 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -2.5030 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.0370 0.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -3.6400 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -3.7780 1.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -4.0990 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -3.9600 3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -4.5320 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -4.5720 4.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -3.9960 4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -3.9760 4.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 -3.3940 3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -2.8200 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -2.8320 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -3.4070 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -3.3790 2.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -5.0280 4.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -4.7670 4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -5.1280 4.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -5.7070 6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -4.7200 7.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -5.4250 8.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 1.3080 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 1.3630 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 1.3390 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -0.6370 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.6150 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -2.9190 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -2.8350 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.9450 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -4.4260 5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -3.3910 4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -2.3640 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -2.3800 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -4.8920 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -5.6280 5.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -6.4470 6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -6.2670 6.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -3.9430 7.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -4.2040 7.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -6.1540 8.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -5.9110 8.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -4.4190 9.7870 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1420 -4.8520 10.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -3.9390 9.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -3.6960 9.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 2 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 45 1 M END