IBS-ZINC04042896 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.2600 0.8560 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.4830 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 2.8190 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.7030 -2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 1.1350 -3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -0.0730 -4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -0.0550 -5.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -1.1850 -3.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -0.8070 -2.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0760 -1.2150 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -1.3160 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -1.1610 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -1.6260 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -2.2510 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -2.4060 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -1.9430 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -2.7230 2.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -2.4460 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -3.4940 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -2.5570 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -3.0730 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -4.5060 -5.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.0210 -5.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -6.4540 -6.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -6.9620 -7.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -6.2510 -7.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 2.2900 -3.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -0.2290 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 1.2080 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 1.1350 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -0.6740 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -1.5040 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.8910 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -2.0670 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -3.2470 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7730 -2.3870 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7060 -1.4990 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -3.5200 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -3.0250 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -4.5110 3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -3.1950 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -2.5730 -4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.4350 -5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.0570 -3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -5.1430 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -4.5210 -5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -4.3830 -6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -5.0060 -5.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -7.0920 -5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -6.4700 -6.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 3.1750 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -8.2040 -7.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -8.4860 -8.1630 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 4 2 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 52 53 1 0 0 0 0 M END