IBS-ZINC01755023 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 2.1430 -0.1320 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -1.1820 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -1.6370 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -2.5930 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -3.1020 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -2.6290 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -1.6740 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -4.1320 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -4.2250 -0.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -5.0550 -2.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1480 -5.9250 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -7.3560 -2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -8.2520 -2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -7.4030 -1.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -6.0930 -1.5970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2150 -5.9250 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -6.0370 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -5.6270 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -5.5740 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -5.9420 -3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -6.3570 -4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -6.3980 -3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0290 -5.8890 -4.4740 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9710 -5.2770 -3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 -6.4440 -5.5820 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0080 -8.6410 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -8.5700 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -9.8770 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -9.8330 1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -8.8090 2.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -5.5610 -3.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -0.2380 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 0.8640 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -0.2220 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.2490 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -2.9420 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -2.9690 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -1.3100 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -5.3540 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -5.2560 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -6.6550 -5.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -6.7350 -4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -9.4580 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -8.8630 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -7.7550 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -8.3350 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -10.6820 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -10.1500 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -4.4730 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -10.8550 2.1230 O 0 5 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 31 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 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 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 50 -1 M END