IBS-ZINC04994250 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.3660 0.7840 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 0.9430 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 2.9800 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 3.5360 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 5.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 5.6230 -1.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 5.7360 -1.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4250 4.7360 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 6.1880 -2.4230 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2230 6.4890 -3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 6.0710 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 6.1280 -2.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 6.9770 -4.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 5.0780 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 3.9010 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 5.4140 -4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5240 6.6510 -4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6260 6.9120 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6150 5.9430 -5.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5050 4.7000 -5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 4.4400 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3960 3.6660 -5.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5270 3.8710 -5.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 6.7020 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 7.9100 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 8.7650 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 8.4330 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 7.2480 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 6.3990 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 5.2660 0.5480 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -0.2960 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 1.0940 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 1.0610 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 1.2020 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.1410 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 1.3990 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 3.2490 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 3.3550 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 3.2070 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 3.1580 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 5.4300 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 5.4310 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 7.0960 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 7.4210 -4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 7.8740 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4530 6.1910 -6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 3.4660 -3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2220 4.0490 -7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1260 2.9550 -5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1540 4.6860 -5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 8.1980 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 9.6940 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 9.1020 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0300 6.9840 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.4690 1.1180 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9770 1.2100 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END