IBS-ZINC02339041 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -2.6760 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -4.0520 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -4.7260 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -6.1450 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -6.1510 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -7.3910 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -8.4980 2.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -8.4440 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -7.3010 1.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -7.4640 3.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -8.7690 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -8.5680 4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -9.9320 4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -9.7440 5.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -4.8750 2.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -3.9990 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -2.6740 1.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -4.8510 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -3.9840 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -2.6940 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.8520 -0.0400 C 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 -1.0200 -0.3810 0.0100 H 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 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 0.9420 -9.3670 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -6.6500 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -9.3280 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -9.3240 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 -8.0090 5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -8.0140 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -10.4910 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -10.4860 5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 -10.5690 5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -5.2240 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -5.6950 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -4.5210 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -3.7400 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -2.9400 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -2.1370 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -1.4790 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -1.0080 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 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 5 1 0 0 0 0 4 21 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END