IBS-ZINC02216114 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9740 -0.1880 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -2.0040 -0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9670 -2.1860 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -2.2770 -0.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6440 -2.1800 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -3.7100 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -4.3070 -1.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -4.1950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -3.1930 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -3.2880 1.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -5.6200 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -6.0380 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -5.9610 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -6.3450 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -6.8060 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -6.8830 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -6.5040 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -7.1810 -3.6330 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -1.1870 -1.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5900 -0.5680 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 0.0840 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 0.5570 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 0.3720 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5120 -0.2820 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 -0.7600 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -1.4400 -3.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 -1.7270 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -2.3070 -3.3570 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 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -5.8000 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -6.1990 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -5.6010 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -6.2840 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -7.2430 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -6.5680 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 0.2260 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0360 1.0690 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1620 0.7410 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 -0.4230 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -1.6790 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -0.1680 -1.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 0.7550 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 51 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 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 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 32 33 2 0 0 0 0 51 52 1 0 0 0 0 M END