IBS-ZINC05016727 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.4660 0.6440 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 0.4870 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.6610 2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 2.0870 3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 1.3980 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 2.7080 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 2.5700 1.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 2.8750 -0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9970 2.2440 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 2.5840 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 2.1370 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 2.1480 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 1.8220 3.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 1.8020 1.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 2.7270 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 2.5680 -0.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 3.0560 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 4.1400 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6430 4.4100 -4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 3.6640 -4.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 2.6350 -4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 2.2880 -3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 4.3280 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 4.6840 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 6.0160 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 6.9940 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 6.6370 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 5.3040 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 8.6680 -1.4430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 0.6240 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.1750 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 1.5930 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 0.5330 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -0.4740 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 2.3980 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 0.6890 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 3.0600 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 1.3510 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 2.1540 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 1.1240 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 0.6090 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 3.5130 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 2.9380 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7760 2.6880 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 4.7560 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 5.2440 -4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 2.0520 -4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 1.4410 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 3.9200 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 6.2930 -2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 7.4000 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 5.0260 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 1.5710 1.4580 N 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 53 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M END