IBS-ZINC05119692 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.0380 1.6890 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 0.1810 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.4680 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.2420 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.4320 4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -1.8280 4.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.5710 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -1.8610 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -2.6360 0.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.0600 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -2.7780 -1.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.5810 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -0.0650 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -0.1080 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -1.2330 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -1.2820 -4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -0.2060 -4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 0.9180 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 0.9660 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -4.0780 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -6.2030 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -6.7810 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -6.5470 1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -5.0690 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.4970 2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -2.4970 5.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 0.4790 5.4620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 2.0290 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 2.1260 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 2.1250 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 1.3290 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.6370 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 0.9550 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -2.0830 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -2.1580 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -0.2420 -4.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 1.7600 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 1.8550 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.4150 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -4.4940 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -6.6960 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -6.2890 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -6.3240 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -7.8560 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -6.9060 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -7.1280 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -4.5080 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -4.9390 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -3.4180 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -4.9720 3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -1.8330 5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -4.7360 2.1750 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2040 -4.2810 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 52 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END