IFLAB-ZINC02966386 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 1.4840 1.0920 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.4110 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.6370 -0.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.9290 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -2.2210 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -3.5340 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.5580 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -4.2690 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -2.9580 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -5.9900 -0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0260 -6.4080 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -7.2020 1.7040 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2080 -7.4450 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -6.9090 -0.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -7.2210 -1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -7.6920 -1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -8.8130 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -8.2340 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -7.6250 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -8.5710 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -8.9940 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -8.4790 5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -7.5380 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -7.1150 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -8.8980 6.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -8.3280 7.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -8.9160 8.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -6.1870 -0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 1.2640 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 1.4930 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 1.5880 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -0.9080 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -0.8130 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -1.4220 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -3.7620 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -5.0700 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -2.7330 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -5.5310 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -7.0170 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -8.0120 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -6.3300 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -8.0650 -2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -6.8580 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -9.5740 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -9.2590 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -7.5760 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -9.0450 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -8.9710 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -9.7250 5.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -7.1400 5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -6.3860 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -8.5540 6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -7.2470 7.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -8.6890 9.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -9.9970 8.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -8.4810 8.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -5.6340 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 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 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 M CHG 1 12 1 M END