IBS-ZINC04600518 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 1.3400 2.3540 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 2.2110 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 2.1340 -2.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 2.0020 -3.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 1.9260 -4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 1.9740 -5.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.7850 -5.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 1.7370 -5.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 1.7090 -7.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 1.7340 -8.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 2.1990 -7.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 2.2230 -9.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 1.7820 -10.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 1.3170 -10.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 1.2970 -9.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 0.8460 -9.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 0.4140 -11.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 1.8070 -11.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 2.2980 -11.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 2.1580 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 2.0590 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.9120 1.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 2.1260 0.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 2.1130 2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 2.0660 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 2.0520 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 2.0870 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 2.1320 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 2.1390 3.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 1.3720 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 2.7910 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 3.0010 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 1.9640 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 1.6380 -7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 2.5420 -7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 2.5850 -8.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 0.9740 -11.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 0.0800 -11.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -0.4100 -11.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 1.2420 -11.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 2.2640 -11.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 1.6790 -10.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 3.3270 -10.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 2.1920 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 2.1720 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 2.1840 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 2.0410 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9960 2.0170 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 2.0780 5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 2.1590 5.0770 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 20 2 0 0 0 0 3 4 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 38 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 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 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 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 M END