IBS-ZINC06623690 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1290 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.7710 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.2890 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -6.7170 -0.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -7.0830 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -7.1370 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -7.5380 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -7.8900 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -7.8390 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -7.4390 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -7.2790 1.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3140 -6.8080 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -6.5570 1.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -6.2490 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -5.1840 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -4.4760 2.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -3.6670 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -5.0840 3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -6.2240 3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -7.0470 4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -6.7430 5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -5.6210 5.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -4.7900 4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -4.8220 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -8.5310 1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1420 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.4880 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.4630 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -6.7760 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -6.5630 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -6.8640 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -7.5780 -4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 -8.2030 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -8.1130 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -7.9220 4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -7.3800 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -5.3930 6.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -3.9210 5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -5.2990 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -3.7400 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -5.1650 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -9.2220 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 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 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 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 19 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 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 M END