IBS-ZINC02153586 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.1350 1.4520 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -0.0170 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -0.8340 -1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -0.6040 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.1070 2.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.2650 3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 0.4870 4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 0.2100 5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -0.8380 5.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -1.5820 4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -1.2970 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 -1.1120 7.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -0.1920 7.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -2.4240 7.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -2.9130 8.5860 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3660 -2.2900 9.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -2.9530 8.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 -1.5890 8.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -0.7990 9.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 0.4700 9.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 0.9470 8.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 0.1760 6.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -1.0920 7.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 2.1870 7.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 2.6160 8.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -4.3970 8.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -5.0160 7.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 1.5700 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 1.8590 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 2.0620 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -0.0600 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -0.8160 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.8790 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.4390 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -1.6630 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -0.5090 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 1.2960 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 0.8060 6.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -2.3770 4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -1.9000 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -3.1810 6.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -3.4860 9.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -3.5330 7.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -1.1670 10.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6600 1.0640 10.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 0.5610 5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -1.6860 6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -4.7980 10.0430 O 0 5 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 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 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 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END