IBS-ZINC02265506 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.0060 2.1290 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.7630 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.0190 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 0.4780 -0.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6000 1.5460 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -0.2300 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -0.0010 -2.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -1.1750 -1.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -1.4680 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5180 -2.3860 -0.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -0.6650 0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 0.3520 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 1.1050 1.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 -0.8770 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9540 -2.2550 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -2.4240 3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2240 -2.1640 3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 -0.7920 3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 -0.6100 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -1.2980 0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.3070 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -3.3590 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -4.3790 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -4.3580 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -3.3180 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.3020 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -3.2930 -2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -2.2310 -2.9260 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8650 2.1680 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 2.4100 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 2.8740 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 0.3730 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -1.7210 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -0.1440 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -3.0650 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -2.3750 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -3.4370 4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -1.7310 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6470 -2.9420 3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7390 -2.2360 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5580 -0.6660 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1840 -0.0100 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8730 0.4100 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -1.2810 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -1.5670 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -3.3910 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -5.1880 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -5.1570 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -1.5130 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -4.3400 -2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 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 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 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 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 2 0 0 0 0 M CHG 1 28 -1 M END