IFLAB-ZINC01805658 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.5000 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -2.7450 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -2.6700 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 -3.0160 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -3.4380 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -3.5280 -4.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -3.1760 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -3.2100 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -3.6230 -5.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -3.9780 -6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -3.9420 -5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.7660 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.6540 -3.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 -3.8580 -4.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2070 -3.1820 -5.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8540 -3.6900 -2.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -5.4760 -4.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 -6.0730 -5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 -7.4480 -5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 -7.8880 -4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 -6.5570 -3.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3280 -6.4290 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 -6.5470 -2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 -5.7230 -2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -2.3430 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 -2.9480 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -3.6700 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -4.2970 -7.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 -4.2260 -6.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -6.2050 -5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 -5.4480 -6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 -8.1450 -6.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4630 -7.3410 -5.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -8.3430 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 -8.5730 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -7.4540 -1.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -7.4080 -0.6000 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 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 16 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 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 49 50 1 0 0 0 0 M END