IFLAB-ZINC02457759 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0680 1.4270 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.0590 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -0.6020 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.1060 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 1.4710 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 2.1280 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 3.8490 -0.4880 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 4.1600 -1.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 4.0710 -1.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 4.6500 1.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 4.5840 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 5.7000 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 5.7670 3.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 5.6540 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 4.5140 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 6.0130 5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 5.9890 5.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 6.3980 5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 7.1430 5.2520 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6330 -0.4850 0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -1.7850 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -2.5790 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -1.9520 0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 1.9330 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -0.4960 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 2.0060 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 3.6060 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 4.6990 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 5.5420 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 6.6750 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 5.5280 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 6.6120 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 4.5610 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 3.5480 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -2.2930 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -1.6650 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -2.6710 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -3.5870 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 5.9470 7.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 19 -1 M END