IBS-ZINC04746272 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0650 1.5180 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 0.0370 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -0.6020 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -1.9700 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -2.7130 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -2.0910 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -0.7110 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -2.8920 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -4.0170 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -4.1280 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -4.6070 -3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -3.7020 -4.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2570 -2.6830 -4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -3.6260 -4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -4.2560 -6.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -4.9370 -6.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -3.9880 -6.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -4.5510 -8.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -5.4800 -8.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6170 -4.8130 -7.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -5.3120 -8.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0390 -4.7190 -7.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9590 -3.6290 -6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 -3.1330 -6.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 -3.7250 -6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -3.1540 -6.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 2.0480 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 1.7840 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 1.8610 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.0350 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -2.4570 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -3.7790 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -0.2050 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -2.3540 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -3.8790 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -3.5740 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -4.9920 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -4.8210 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -3.1520 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -5.6390 -3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 -4.6460 -3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -4.5990 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -2.9200 -4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -3.7110 -8.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -5.0990 -8.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5030 -5.7870 -9.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -6.3810 -7.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -6.1630 -8.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0100 -5.1080 -7.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8700 -3.1660 -6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -2.2810 -5.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -2.9850 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -2.1830 -6.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -3.1160 -2.8270 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7430 -2.1930 -2.7920 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 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 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 54 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 54 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END