IBS-ZINC02221456 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 4.9800 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 5.3940 -1.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 5.5410 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 5.9430 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 6.0530 -3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 5.6930 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 5.7060 -2.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 6.0500 -4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 6.0660 -4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 6.4180 -6.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 6.7630 -6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 6.7590 -6.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 6.4020 -4.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 6.3850 -4.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 6.2040 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 7.3230 -2.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8670 5.2080 -2.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2820 5.4690 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9560 4.1800 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9500 3.2230 -2.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5600 1.9760 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 5.3220 0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.3120 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 5.4260 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 5.8010 -4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 6.4290 -6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 7.0390 -7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 7.0300 -6.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5050 4.3170 -2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7710 5.8240 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3640 6.2290 -3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9840 4.3930 -3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4110 3.7780 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0280 1.5280 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5150 1.3040 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6010 2.1430 -3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 5.0420 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 5.4490 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 53 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 53 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 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END