IBS-ZINC05025464 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.1270 1.6720 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 0.1720 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.1780 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -1.6650 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -2.1990 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.6260 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -4.0720 -2.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -4.4420 -1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -3.9240 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.5520 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -2.0990 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -2.9940 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -4.3540 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -4.8470 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -6.3210 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -8.5240 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 -9.1520 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -8.8740 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 -7.3790 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 -6.7620 -2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -5.2470 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -2.4080 1.1600 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 2.0510 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 2.2080 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 1.9020 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.3310 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -0.1790 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 0.3430 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 0.2220 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -1.5900 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -1.0480 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -6.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -6.5190 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -8.9580 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -8.6420 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -8.7590 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -10.2340 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4490 -9.2710 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -9.3970 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 -6.8760 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -7.2140 -3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -5.6760 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -7.1800 -3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -4.7390 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -7.0490 -1.2220 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2430 -6.6270 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 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 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 45 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END