IBS-ZINC05156777 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.8690 -0.9100 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.0270 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 1.4110 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.5430 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -0.9510 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -1.4240 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.4890 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -1.0780 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.6010 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -1.9680 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 -1.7440 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 -1.0480 2.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4870 -2.3600 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 -1.9690 2.4190 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.1500 -2.6920 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 -2.0020 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2770 -0.8370 3.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -0.8560 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2250 0.4100 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6410 1.3760 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0440 0.3890 4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1250 -2.4200 5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 -3.5840 6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7970 -3.9690 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6250 -3.2030 8.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2040 -2.0470 7.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9540 -1.6490 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9390 -3.6940 10.1160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.5370 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -1.9340 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.8860 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -0.0510 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.4340 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 2.0390 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 1.7840 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.9000 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -1.7430 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -1.1270 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -0.2780 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 -2.4610 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0790 -2.0100 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4010 -3.4460 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -3.6520 3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 0.8200 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0680 0.2110 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 2.0020 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4920 1.9860 2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1130 0.1800 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7710 0.8020 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 -4.1830 5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -4.8700 8.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8480 -1.4540 8.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4020 -0.7450 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 14 1 M END