IBS-ZINC06661055 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.1530 1.7510 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 0.2250 0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4550 -0.1610 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.1700 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -0.8510 -1.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 0.2320 -1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.1520 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 0.4310 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 0.0350 -3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 0.8450 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 0.4850 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -0.6910 -5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -1.5020 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -1.1340 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 -1.0480 -7.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.3330 0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -1.1690 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -1.5090 2.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -1.6570 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -2.5140 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 -2.7600 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -3.9180 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2590 -4.1400 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0120 -3.2220 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -2.0740 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 -1.8340 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -0.8650 -0.5330 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 0.0040 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 1.0700 -2.1300 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 2.1660 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 2.1360 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 2.0370 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 0.7770 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -1.2390 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.2340 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 1.5180 -2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 0.0450 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 1.7600 -4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 1.1180 -6.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 -2.4180 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -1.7630 -2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7380 -0.7120 -7.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -3.0170 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -4.6350 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7250 -5.0330 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0650 -3.4030 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0190 -1.3630 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -0.9360 0.4280 H 0 0 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 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 M END