IBS-ZINC05575788 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0200 1.5030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0040 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -0.7080 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -2.0890 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -2.0620 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -0.6800 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0900 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1720 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -4.9010 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -4.4520 2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -6.3710 0.7380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6240 -6.9210 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -6.9650 1.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0520 -6.5080 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -8.5000 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -9.0090 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -7.8680 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -6.9760 -1.3470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1780 -8.0410 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -6.3630 -0.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8800 -6.9060 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -4.8920 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -4.4340 -2.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -6.2720 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -5.4720 -2.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -6.5580 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -5.9080 -5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -6.1810 -6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -7.0960 -6.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -7.7430 -5.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -7.4860 -3.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.8560 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 1.8810 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.8610 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.1770 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -2.6380 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -2.5890 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.2670 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -0.4840 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 1.0460 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -8.7880 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -8.8750 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -9.2050 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -9.9110 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 -7.5070 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -8.2240 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -5.1930 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -5.6800 -7.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -7.3050 -7.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -8.4560 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -7.9960 -3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -6.7680 -0.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 23 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 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 53 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 19 53 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 M END