IBS-ZINC02096964 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.2000 1.5570 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 0.0420 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.5220 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -1.9840 1.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -2.5340 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -2.7000 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -3.3010 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -2.7300 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -2.2210 2.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -4.2080 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -4.9790 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -6.4660 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -8.4100 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 -8.8520 5.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0240 -9.9390 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -8.5240 6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -7.0120 6.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3390 -6.7680 6.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -6.5730 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -6.2770 6.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -5.0740 7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -4.3460 7.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -4.8440 7.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -6.1760 6.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -6.6320 6.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -6.8470 6.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -8.2010 5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 2.0180 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.9400 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.8730 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -0.3880 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.2430 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -0.1020 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.2350 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -3.4930 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -1.8600 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -1.7290 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -3.3400 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -4.2920 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -2.6630 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 -3.4070 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -4.6360 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -4.5130 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -6.8970 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -6.8850 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -8.9530 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -8.5730 3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -8.8680 7.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -9.0430 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -5.4890 4.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -7.0730 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -4.6000 7.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -3.3750 8.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -4.3200 7.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -8.2000 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -8.8140 6.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -6.9380 3.7960 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0750 -6.4300 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END