CHEMDIV-ZINC06802817 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -1.3540 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.5470 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -0.7580 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -0.1380 1.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -0.6540 3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -2.4170 4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -2.5900 5.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -3.4800 6.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -4.2280 5.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2010 -4.4140 6.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -3.2560 4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -5.5210 5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -5.7730 4.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -6.3960 4.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -7.6630 3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -7.7980 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -7.6450 2.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -6.3060 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -6.1130 4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -7.9230 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -7.8360 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -8.1100 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -8.4720 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -8.5590 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -8.2810 0.5200 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 -0.7550 -1.8120 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -1.4140 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 0.3350 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -0.8060 4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -2.6350 5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -3.8040 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -7.6610 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -8.4960 4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -7.0240 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -8.7800 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -5.5530 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -6.2060 3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -6.8000 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -5.0850 5.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -7.5540 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -8.0430 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 -8.6860 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -8.8420 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -8.3450 0.5170 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 7 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 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 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M END