IBS-ZINC04729873 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 6.4420 5.0650 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 4.5990 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 3.2460 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 2.3600 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 2.8260 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 4.1790 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 0.8850 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 0.2780 -1.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -1.0260 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -1.6800 -0.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 -1.6600 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -1.3880 -4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -0.5730 -3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 0.3240 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 1.0850 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 0.9620 -3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 0.0770 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -0.6950 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -0.0460 -1.2010 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0040 0.6320 -0.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -0.8240 -0.3490 O 0 5 0 0 0 0 0 0 0 0 0 0 6.6610 -2.5430 -3.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 -2.8540 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -2.4390 -1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 -3.7010 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5230 -4.0260 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6290 -4.8170 -1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8950 -5.2880 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0540 -4.9700 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9410 -4.1850 -3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 6.1220 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 5.2910 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 2.8810 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9700 2.1340 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 4.5440 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 0.4140 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 0.7410 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 0.8160 -2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -1.7700 -5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 0.4220 -5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 1.7780 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 1.5600 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -1.3880 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 -2.9310 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 -3.6580 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2900 -5.0690 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7630 -5.9070 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2670 -5.3410 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 -3.9400 -4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 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 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END