IFLAB-ZINC02722017 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.2460 1.1200 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 0.4930 -0.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -0.0620 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -0.0030 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -0.5650 -3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.1950 -4.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -1.2550 -4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -0.6950 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -0.7560 -2.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -1.4190 -4.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -1.7970 -5.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -2.3450 -6.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.7380 -5.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -2.3980 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -1.8010 -7.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -2.8090 -8.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 -2.6930 -8.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -4.0080 -7.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -3.7480 -6.5110 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3420 -4.7420 -5.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -6.0450 -6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -6.3570 -7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -5.3240 -7.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -0.3480 -7.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 0.1900 -7.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 1.5480 -8.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 2.3780 -8.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 1.8500 -7.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 0.4930 -7.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 3.7080 -8.2110 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 0.3870 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 1.9300 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 1.5210 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 0.4850 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -0.5170 -3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -1.7420 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -2.4540 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -1.3960 -3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -0.9130 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -1.2370 -4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -4.5060 -4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -6.8340 -5.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -7.3860 -7.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -5.5330 -8.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 -0.4550 -8.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 1.9650 -8.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 2.5020 -7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 0.0820 -7.2440 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 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 40 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M CHG 1 19 1 M END