IFLAB-ZINC04086864 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7650 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1140 -3.1240 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -2.7290 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -3.9510 -2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -4.8480 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -4.0490 -4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -4.3010 -5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -3.7760 -4.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -3.9000 -4.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1920 -3.1980 -3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -3.1920 -5.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -3.4840 -6.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -2.6960 -7.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -1.7630 -7.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -1.8490 -6.3640 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -5.2730 -4.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2850 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -2.1280 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -2.1280 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -3.6330 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -4.4950 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -5.3740 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -5.5820 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -2.9880 -4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -4.4030 -5.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -3.8270 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -5.3750 -5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -3.8950 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -2.3390 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -4.2760 -6.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -2.8260 -8.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -1.0600 -8.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -5.4060 -4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -4.6620 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.6430 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.6390 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 M CHG 1 8 1 M END