CHEMDIV-ZINC04101344 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 -0.0910 1.4680 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.0430 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7860 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -2.1340 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -2.7300 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -1.9590 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.6030 -1.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.8600 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -2.6570 -3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -3.8270 -4.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -5.0520 -3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -5.2590 -2.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -4.1290 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -4.0600 -0.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -6.1590 -4.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -7.5080 -3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -8.4720 -4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -8.4030 -6.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -7.0810 -6.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -6.0410 -5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -1.4080 -4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -1.1520 -5.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 0.0270 -6.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 0.9840 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 0.7430 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -0.4420 -4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 2.0890 -6.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 3.1020 -6.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.0660 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -0.0160 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 0.2250 3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 0.8470 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 1.3130 5.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.8930 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 1.8620 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 1.7770 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -7.8230 -3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -7.5760 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -9.5010 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -8.2550 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -7.0840 -7.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -6.8480 -6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -5.0520 -6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -6.2270 -6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -1.8790 -5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 0.1950 -6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 1.4500 -4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -0.6010 -3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 2.7230 -6.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 3.5180 -5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 3.9110 -7.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -3.7040 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -3.7080 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.5530 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 0.9340 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.5580 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -0.7200 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 0.8900 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 0.8180 5.1890 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 20 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 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 M CHG 1 59 -1 M END