IBS-ZINC01755023 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0450 1.5820 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.0840 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.5980 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.9930 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.7220 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -2.0430 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -0.6480 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.1850 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.7690 1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.8750 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2830 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -5.4020 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -5.2250 -4.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -6.5740 -2.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.3810 -1.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8480 -6.7780 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -7.0720 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -8.2110 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -8.8710 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -8.3950 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -7.2710 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -6.6180 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -9.0790 0.9470 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3920 -10.0910 1.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -8.6010 0.7680 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2040 -7.8890 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -8.5220 -3.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -9.9280 -4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -10.7010 -4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -10.0120 -5.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.1050 -2.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 1.9800 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 1.9430 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 1.9790 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -0.0460 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -2.5050 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -2.5920 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -0.1360 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -8.6050 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -9.7500 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 -6.8950 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -5.7570 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -8.5310 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -7.7720 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -7.8890 -4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -8.5770 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -10.5040 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -9.8770 -5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -5.7240 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -11.9550 -4.5910 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 1 0 0 0 0 8 10 2 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 15 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