IBS-ZINC05186250 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -2.3450 0.6080 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -0.4080 2.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -0.9170 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -0.5220 2.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -1.9520 3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -2.4080 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -3.3760 5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -3.8990 5.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -3.4570 5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -2.4880 4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -2.0560 4.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -2.6820 4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -1.9410 5.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -0.5430 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 0.1200 6.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 -0.5740 6.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -1.9360 6.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -2.6500 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -3.9880 5.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -4.6300 5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -4.0010 4.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -6.1100 5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -6.8350 6.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -8.2130 6.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -8.8800 5.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -8.1730 4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -6.7880 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -6.0920 3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 0.1940 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 0.9310 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 1.4600 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -2.0030 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -3.7280 5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -4.6570 6.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -3.8690 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 0.0070 4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 1.1990 6.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -0.0260 7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7910 -2.4610 6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -6.3180 7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -8.7730 7.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -9.9600 5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -8.7000 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -5.8110 2.4100 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 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 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 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 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 M END