IBS-ZINC05488008 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1950 1.6670 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 0.2090 0.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0520 0.1070 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -0.2080 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -1.5490 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -1.9320 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -0.9720 -3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 0.3690 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 0.7520 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -0.6450 0.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.3100 0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8970 -1.1300 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 0.9660 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 1.3520 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 1.5280 -1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 0.3540 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -0.0740 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -0.7730 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 0.6520 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -1.7390 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.0440 1.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -2.5680 1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -1.9710 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -2.7500 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -4.1220 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -4.7210 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -3.9520 1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -4.7040 1.5320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.7640 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 2.2990 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 1.9770 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.2990 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -2.9800 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -1.2710 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 1.1190 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.8000 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 1.7730 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 0.7880 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 2.2830 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 0.5620 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -0.9950 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 0.7120 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -0.9850 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -1.6680 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -0.4690 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 0.9560 -3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -0.2440 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 1.4550 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -0.9020 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -2.2900 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -4.7270 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -5.7910 2.3420 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 10 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 M END