IFLAB-ZINC00075244 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 2.4440 0.7630 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -0.0570 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -0.5610 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.2430 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -1.1660 -0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -0.4130 -0.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -1.7360 -2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -1.0820 -3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -1.6450 -4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -2.8600 -4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -3.5150 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -2.9580 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -1.8830 0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.3810 2.5890 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9630 0.1100 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -1.7490 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -2.5300 3.0880 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2160 -2.0120 3.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -3.6990 2.7510 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1370 0.4680 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 1.8060 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 2.5860 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 2.0260 3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 0.6860 3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -0.0910 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 2.7870 3.6120 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 0.1000 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 1.4370 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 1.3440 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.1320 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.1370 -5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -3.2990 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -4.4630 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -3.4720 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -1.3580 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.6140 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -2.2760 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 2.2430 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 3.6320 3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.2480 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -1.1360 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 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 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END