IBS-ZINC02260006 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 0.5600 1.3900 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.1090 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.6700 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -2.0510 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -2.8830 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -2.3520 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -0.9590 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.4150 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -0.0020 -3.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 0.9960 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 1.6140 -4.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 1.3150 -4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 2.8190 -5.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 4.1630 -6.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 5.3250 -5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 5.1510 -4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 3.8070 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -4.3450 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -4.9750 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -4.2620 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -4.9280 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -6.3050 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -7.0190 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -6.3500 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -7.1060 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -8.3210 0.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -6.3730 0.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -5.0170 0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -7.0340 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 1.6980 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 1.7510 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 1.8840 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.0300 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -2.4650 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -3.0270 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -1.1800 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 0.4180 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -0.4940 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 1.2970 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 0.5790 -4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 2.0010 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 2.7080 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 4.2740 -6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 4.1930 -7.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 5.3900 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 6.2680 -5.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 5.9590 -3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 5.2370 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 3.7180 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 3.6580 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -3.1900 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -4.3710 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -6.8230 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -8.0960 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -6.8370 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -6.6250 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -8.1150 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 2.6990 -4.7730 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9850 2.7810 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 28 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END