IBS-ZINC02107339 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.4740 1.6240 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.3140 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -0.5780 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -0.2300 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -1.1080 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -2.3500 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -2.7440 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.8310 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -2.2250 0.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -1.4020 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -1.7760 0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.0750 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 0.7580 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 0.3990 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 1.1320 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 2.1090 -0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 0.5810 -2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 1.0570 -2.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0660 1.3260 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5920 2.2590 -3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 3.4840 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1130 4.5970 -4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 4.5000 -5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 3.2910 -5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 2.1770 -4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4720 -0.0740 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7860 -0.9840 -3.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -4.0810 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -3.1330 0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.4550 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 2.1740 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 2.2810 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 0.7300 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -0.8200 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 0.6180 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 1.8300 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 0.6580 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -0.6800 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -0.2350 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 3.5760 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 5.5380 -3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 5.3660 -5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 3.2110 -6.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 1.2370 -5.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -4.1370 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -4.2760 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -4.8840 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -3.9610 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7230 0.0230 -3.2040 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 12 2 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 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 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 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 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M CHG 1 49 -1 M END