IBS-ZINC05389087 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0720 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -5.2730 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -6.7610 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -7.2470 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -8.4230 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -8.9320 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -8.2620 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -7.0920 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -6.5810 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -5.2920 1.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5010 -5.3580 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -4.1420 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -8.7560 3.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 -8.0140 4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 -10.0820 1.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -10.7130 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2690 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5200 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0160 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -4.6850 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -4.9920 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -6.9220 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -7.3250 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -8.9430 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -6.5700 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -4.0740 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -4.3260 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -3.2070 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -7.9480 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -7.0100 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -8.5160 5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9410 -11.6170 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -10.0300 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 -10.9740 -0.6060 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 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 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 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 20 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 26 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 25 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 M END