IBS-ZINC02284586 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.3360 1.0370 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.3610 0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7790 -1.0400 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -0.4270 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 0.2780 2.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1140 1.3550 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -0.2380 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.8510 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -0.4370 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 0.4470 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 1.3700 -0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 0.1840 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 -0.8970 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5420 -0.3470 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1880 0.6900 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5890 1.3300 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5370 2.2580 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5280 3.1850 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6640 3.9660 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7980 3.8350 -1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8340 2.9220 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6900 2.1470 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4510 1.1830 0.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1190 0.8960 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 1.0300 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 0.0940 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 1.3360 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 1.0480 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 1.8000 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -1.4830 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 0.0030 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -1.2960 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 0.3550 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.7010 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -1.9140 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -0.2200 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -1.5010 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6330 -1.5560 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -1.5000 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2330 -1.1610 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2180 0.1130 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 3.2980 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6630 4.6820 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6700 4.4520 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7200 2.8240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 1.9560 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2370 0.4610 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 0.4900 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 0.6260 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -0.9630 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -0.1000 1.2070 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9340 0.9000 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 26 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 51 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 51 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END