IBS-ZINC01060229 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 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 0.7420 -0.5130 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.0420 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.0650 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5350 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.9600 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -4.3230 2.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -4.6070 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -4.6280 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -4.9480 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -5.2520 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -5.2370 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -4.9150 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -4.8100 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -5.0140 4.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 -4.8740 5.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -4.1780 6.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -4.0390 8.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -4.5870 8.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -5.2780 7.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -5.4280 6.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -4.4470 9.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -5.0340 9.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -4.4300 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -4.2460 4.2330 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 0.5100 -0.3560 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -0.1730 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.1270 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -2.4280 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.4070 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -2.4460 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -2.4500 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.1500 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.2120 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -4.2960 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -4.4350 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -4.3930 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -4.9610 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7050 -5.5000 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -5.4740 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -3.7520 6.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -3.5040 8.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -5.7000 7.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -5.9700 5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -6.1080 9.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -4.5920 8.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.8480 10.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -2.5010 1.2780 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 6 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 52 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 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 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 M END