IBS-ZINC02358011 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8220 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -2.3480 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -3.7060 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -4.5640 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -4.0290 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -2.6690 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -6.0190 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -6.4800 2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -6.9400 0.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6400 -6.4860 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -7.1730 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -8.2200 0.7450 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3440 -9.0380 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -10.1190 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -9.9190 0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -8.7420 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -8.4650 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -9.8370 -2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -10.5460 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -11.2800 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -11.3920 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -12.4780 4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -13.4540 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -13.3500 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -12.2720 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.6860 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -4.1140 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.6860 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -2.2560 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -6.2200 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -7.8380 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -7.6260 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -8.8700 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -8.1070 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -7.7420 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -10.3690 -2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 -9.7210 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -10.3990 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -11.6090 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -10.6300 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -12.5650 5.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -14.3020 4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -14.1160 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -12.1930 0.7850 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 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 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 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 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 15 1 M END