IBS-ZINC02128694 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.7630 1.4280 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -0.0870 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -0.5200 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -2.0470 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -2.5200 -0.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8920 -2.1250 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -4.0610 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -4.7300 -1.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -4.6570 1.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -4.0300 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -5.1530 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -6.3790 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -6.1180 1.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0710 -6.5930 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -6.7010 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -5.9570 0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -2.0650 -1.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 -1.7320 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -1.7650 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -1.3250 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 -0.9770 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5920 -0.6020 -3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -0.5730 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 -0.9210 -4.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -1.2980 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -1.6510 -3.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -1.6390 -4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -2.0370 -2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -2.3110 -3.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 1.7160 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 1.8550 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 1.8710 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.5000 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -0.4840 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -0.1030 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.1060 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.4850 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.4290 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -3.6820 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -3.1880 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -4.9780 4.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -5.2740 3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -6.4620 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -7.3030 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -1.0020 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6320 -0.3330 -2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -0.2810 -5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -0.8940 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -7.8880 0.1250 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 49 -1 M END