IBS-ZINC02285878 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.5030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -0.6910 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.0720 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -2.0780 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -0.6970 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1690 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.9400 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -6.0740 -1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9740 -5.6560 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -7.0280 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -6.2430 1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -4.9020 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.4830 2.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -5.4960 3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -6.6410 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -7.8820 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -8.8910 2.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -7.8950 4.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -6.7940 5.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -6.8930 6.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -5.5800 4.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -4.4040 5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -9.1610 5.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -9.3120 5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -10.6140 6.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -11.3450 6.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -6.7940 -2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 1.8500 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 1.8710 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 1.8760 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -0.1470 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -2.6070 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -2.6180 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.1580 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -5.3580 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -4.2880 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -7.5860 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -7.7200 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -4.3180 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -4.5080 6.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -3.5090 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -9.1660 6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -9.9890 4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -9.3070 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -8.4840 6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -6.2540 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 -10.9610 6.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -11.8050 6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 29 48 1 0 0 0 0 49 50 1 0 0 0 0 M END