IBS-ZINC02431589 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -2.0280 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -2.2670 -0.1180 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8440 -1.1350 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -0.1240 0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 1.1750 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0940 0.9200 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -0.5850 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -3.5920 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 -4.1170 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 -5.5000 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 -6.0020 2.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -6.7340 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -7.0780 2.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -7.0510 4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 -7.7560 5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 -7.8680 6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4880 -7.2820 6.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 -6.5730 5.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 -6.4530 4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 -5.7970 3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -5.1760 2.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9870 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -2.7710 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 1.9050 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 1.5250 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 1.1120 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 1.5190 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 -0.7270 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 -1.0620 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -4.2760 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -3.5200 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -3.4330 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 -4.1890 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 -6.1840 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6780 -5.4280 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -8.2160 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -8.4170 7.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1470 -7.3760 7.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8810 -6.1170 5.5250 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 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 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 9 1 M END