IBS-ZINC04296117 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.7820 1.7420 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 0.2370 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.4260 -1.3690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1670 0.0510 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -1.8900 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.7170 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -2.2800 -1.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -1.3040 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -1.7860 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -3.2060 -2.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1310 -3.6710 -3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -5.0930 -3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -6.0330 -3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -5.5700 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -4.1480 -2.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4700 -4.1330 -3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -3.6920 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -3.2130 -1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.2800 -1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -0.0500 -3.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 0.1100 -3.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -1.0500 -4.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 1.4950 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 2.6460 -3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 3.8580 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 3.9190 -4.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 2.7680 -4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 1.5550 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 5.2400 -5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 1.9190 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 2.1520 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 2.2270 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.1880 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 0.0640 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -1.2200 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.3330 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -1.1200 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -1.7840 -3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -3.0010 -3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -3.6590 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -5.1060 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 -5.4220 -4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -7.0460 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -6.0170 -4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -5.5850 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -6.2410 -1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -4.2980 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -3.8040 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8180 -2.6390 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -0.3170 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 2.5980 -3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 4.7560 -4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 2.8160 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 0.6560 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 5.3990 -6.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 5.2340 -4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 6.0440 -4.4630 H 0 0 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 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 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END