IBS-ZINC05252688 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 0.6480 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 1.0120 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 0.5900 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.1950 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -0.5540 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.0360 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -2.7180 -0.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.6220 1.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -4.0160 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -4.8720 0.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -6.0970 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -6.0460 2.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -4.6990 2.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -7.2390 2.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8030 -7.0410 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -8.3860 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -8.4320 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -9.5080 0.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -7.3040 0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -7.6100 3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -7.6480 5.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -7.9890 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -8.2910 5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -8.2520 4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -7.9080 3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 0.9780 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 1.6250 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 0.8740 -4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -0.5240 -4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -1.1650 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.0770 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -8.2460 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -9.3300 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -7.3370 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -7.4120 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -8.0190 7.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -8.5580 6.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -8.4890 3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -7.8740 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 M END