IBS-ZINC04084650 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 67 0 0 1 0 0 0 0 0999 V2000 0.3350 -0.6180 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.0390 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -0.3390 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 1.4880 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -0.5670 -0.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6020 -0.0790 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.0560 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -2.8180 -0.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.5400 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -3.9820 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -4.2620 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -3.6770 3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -5.7510 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -6.0320 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -5.6460 4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -6.2310 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -4.1570 4.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -3.8760 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -5.9220 5.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -6.3830 6.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -5.6570 5.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -5.9260 7.2590 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1060 -6.8180 7.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -4.7320 8.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 -6.1450 7.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -6.0830 5.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -0.2810 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 0.9160 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 1.7600 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 1.1790 -2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 2.4900 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 3.5690 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 2.6020 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 2.6780 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -0.2420 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -1.7060 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.3190 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 1.7850 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 1.8950 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 1.8710 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -1.9340 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -4.3380 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -4.4980 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -6.0270 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -6.3370 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -5.4460 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -7.0930 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -3.5710 4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -3.8810 4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -4.4620 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -2.8150 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -5.2890 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -3.8400 7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -4.5740 8.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -4.9320 9.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -0.9540 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 3.4350 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 4.5530 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 3.4890 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 1.8330 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 3.5860 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 2.4680 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 2.5980 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 3.6620 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 1.9090 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 -6.4090 8.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7550 -6.5420 7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 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 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 66 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 66 67 1 0 0 0 0 M END