IBS-ZINC05306751 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 1.1710 1.4490 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 0.0210 -0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.6060 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.1400 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -0.4940 3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.8770 3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -2.6290 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -1.9900 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -4.0280 2.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.7670 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -4.2240 0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -6.2690 1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -6.8610 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -6.3170 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -6.7040 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -6.1120 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -6.6560 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -6.1600 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -6.6310 2.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 -5.8920 3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -6.2410 5.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -7.3900 5.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 -7.7660 6.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8550 -8.9400 6.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 -9.7580 5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 -9.4080 4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -8.2230 4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -7.7960 2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 -8.4650 1.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -2.5000 4.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -1.6670 5.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 1.8380 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 1.8210 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 1.7780 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 1.2180 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 0.0890 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -2.5710 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -4.4640 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -6.6560 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -6.5850 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -7.9470 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -5.2310 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -6.7390 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -7.7900 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -5.0260 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -6.3880 3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -7.7420 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -6.2340 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -5.0700 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -6.5120 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -4.9660 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -7.1390 7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 -9.2300 7.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5390 -10.6750 5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4700 -10.0480 3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -2.2890 6.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -1.0070 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -1.0690 5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 17 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END