IBS-ZINC02138493 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.6130 0.2940 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.2540 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.2830 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.6610 -0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0560 -1.6480 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -0.0800 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 0.5590 0.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.2690 2.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -0.7130 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 0.1950 3.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0670 0.0800 2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -0.6210 4.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 -1.0160 5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -1.7640 6.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -2.1190 6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -1.7250 6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -0.9800 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 1.6470 3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 2.2340 3.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -0.7770 -1.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 0.3460 -1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 0.3260 -3.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -0.8390 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 -0.8600 -4.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -2.0660 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -3.2630 -4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -3.2680 -3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -2.0580 -3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -2.0010 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -3.0150 -1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 0.9570 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.6640 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -0.7090 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 1.2600 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.3210 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.2230 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 0.3140 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -0.7390 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -2.0720 6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -2.7030 7.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.0010 6.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -0.6750 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 1.3030 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 0.0640 -5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -2.0810 -6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -4.1990 -5.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -4.2020 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 2.2880 4.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 3.2190 4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 20 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 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 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 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 48 49 1 0 0 0 0 M END