IBS-ZINC02448592 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 2.3420 -1.5930 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -1.4880 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -2.2280 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.1320 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.2970 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -0.5550 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.6440 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.1110 -2.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -0.5040 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -1.6980 -3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 0.2930 -4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -0.5980 -5.9480 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7490 -0.8100 -6.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -1.6930 -7.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.0040 -7.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.3120 -6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -1.6190 -6.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -2.9110 -7.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -2.8180 -8.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -2.2180 -8.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -1.8900 -8.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -2.3800 -9.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -3.2000 -10.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -3.5290 -10.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -3.0470 -9.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 -3.6810 -10.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 -4.5190 -12.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 0.3550 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -2.4660 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -0.6950 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -1.6940 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -2.8820 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -2.7120 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -1.2250 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 1.0760 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 0.7640 -4.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 1.0620 -4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -0.3590 -6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -1.7910 -5.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -0.8070 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -3.7950 -6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -2.9000 -7.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -2.3360 -9.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -3.8150 -8.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 -1.2510 -7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 -2.1270 -8.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -4.1670 -11.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -3.3070 -9.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 -5.3970 -11.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -3.9660 -12.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -4.8340 -12.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 1.3670 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 0.3550 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 0.0000 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M CHG 1 12 1 M END