IBS-ZINC04729131 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.4460 0.8050 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 0.4030 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 2.7690 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 3.4080 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 5.4130 3.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8010 4.4640 3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 4.9620 4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 5.2060 6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 6.1700 5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 5.7070 4.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6090 4.7520 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 6.7020 4.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 6.7990 3.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6990 7.5020 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 5.4330 2.8380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5970 5.7280 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 6.4150 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 7.6950 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 7.4660 3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 4.4780 3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 3.6880 4.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 6.6650 2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 7.6310 2.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -0.2260 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 0.8630 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 1.4350 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 0.4940 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.6220 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 0.7010 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 3.2820 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 2.7820 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 3.1850 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 2.8770 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 4.3150 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 3.4780 4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 5.8810 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 4.2150 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 5.6070 6.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 4.2530 6.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 7.1660 5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 6.2680 6.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 7.7070 5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 6.4010 5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 4.8220 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 6.3700 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 5.7260 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 6.6460 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 8.0950 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 8.4540 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 8.4320 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 6.8560 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 1.3050 1.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0490 1.2420 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 4.8700 2.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 52 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 52 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 22 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 3 0 0 0 0 22 23 3 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END