IBS-ZINC05164702 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.8790 1.5020 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 0.0020 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -0.7560 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.1310 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -2.7520 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -1.9860 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.6120 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -4.1430 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -4.8420 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -4.1680 -2.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -4.8060 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -6.1980 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -6.8700 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -6.1650 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -8.2560 -2.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -8.9260 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -8.2760 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -8.9400 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -10.2520 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -10.9060 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -10.2500 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -10.8940 -2.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -12.2490 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -6.9440 -4.8320 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6360 -7.2300 -5.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -7.2720 -5.3270 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4620 -4.0930 -4.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 1.7850 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 1.9570 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 1.8500 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -0.2730 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -2.7230 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.4660 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -0.0160 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -4.6190 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -8.7620 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -7.2520 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -8.4330 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -10.7670 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -11.9300 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -12.2910 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -12.8480 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -12.6440 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -3.1240 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -4.5640 -5.5770 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END