IBS-ZINC05248662 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -1.7360 1.9950 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 0.6990 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 0.6360 -2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -0.5840 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -1.6970 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -1.6560 -0.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -0.5020 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -0.7170 0.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -2.0420 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -2.6380 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -3.9190 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -4.7450 -0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -4.2770 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -5.6400 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -5.7780 2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -6.8180 3.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 -4.5420 3.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -3.5150 2.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3330 -3.1710 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -2.3580 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7060 -1.0410 2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 0.0440 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 -0.1720 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2170 -1.4720 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 -2.5590 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -4.2820 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -4.2040 5.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -4.3530 7.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3910 -2.8710 7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -6.5050 0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -2.6270 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 2.8020 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 2.3160 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.8670 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 1.5090 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 -0.5690 -3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -2.6370 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -0.8410 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 1.0580 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 0.6730 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1950 -1.6390 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 -3.5620 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -3.3550 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -5.0920 4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -5.1050 5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -3.3280 5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -3.5400 7.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -5.3210 7.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -4.3630 8.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 -2.8340 6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -2.0170 7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 -2.9060 8.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -5.6100 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -2.4990 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -3.6960 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -2.1360 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6440 -4.1360 6.9870 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2920 -4.9220 7.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 30 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 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 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 57 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 57 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 57 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END