IFLAB-ZINC04139566 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.7410 -2.0220 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -1.9820 -0.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3180 -2.3790 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.5360 0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8020 -0.4960 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.0290 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 0.0700 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 0.5640 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.8670 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 0.5160 -1.1580 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -0.1710 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 0.6780 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 2.5620 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 1.7140 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 2.9280 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 4.3130 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 5.2790 -2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 6.5500 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 6.8560 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 5.8910 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 4.6210 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -2.7940 0.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -4.3710 0.7550 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -4.8220 1.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -4.3120 1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -5.2000 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -3.0480 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -1.3940 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -1.6530 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.2140 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 0.6950 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 1.2630 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -0.0810 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -1.2140 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 0.5660 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.3470 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 3.6060 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 2.4730 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 2.0440 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 1.8250 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 2.4930 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 2.9830 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 5.0400 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 7.3040 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 7.8490 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 6.1300 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 3.8680 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.4090 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -5.1050 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -6.2560 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -4.7390 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 0.3020 -0.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 2.0890 -1.6780 N 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 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 52 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 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 11 52 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 53 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 13 53 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 M END