IBS-ZINC01256525 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 1.1300 -0.4660 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 0.2590 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 1.6140 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 2.2570 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 1.5270 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 0.1580 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 2.2000 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 1.5380 -0.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 0.1540 -0.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -0.4390 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 -1.8230 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -2.1090 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -0.7980 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0470 -0.7310 1.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -1.8560 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -1.7930 4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 -2.9410 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 -4.1870 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -4.2880 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -3.1220 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -3.2100 0.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -2.7740 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -3.1570 -3.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -3.2530 -2.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -4.2340 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -4.6040 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -3.9840 -5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -4.5020 -5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -5.5430 -4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -5.9240 -3.4140 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 0.2350 -2.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 3.5880 -1.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.5240 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -0.2380 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 2.1720 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -0.4110 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 3.2460 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 -0.8360 4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 -2.8870 5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 -5.0840 4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -5.2600 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -2.9470 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -3.8060 -4.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -5.1260 -3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -3.1420 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -4.0940 -5.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -6.0720 -4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 1.2050 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -0.2580 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 4.1470 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 M END