IBS-ZINC05027058 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.8560 0.7010 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -0.6210 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.9140 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 0.1120 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 1.4400 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.7300 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -0.2570 0.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4620 -1.2060 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -0.3780 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 0.8280 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 1.4770 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 2.4410 0.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 0.7550 -0.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 0.9430 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 0.1790 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 0.3360 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 1.2580 -4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 2.0390 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 1.8710 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 3.0340 -4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 3.6950 -4.0250 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3490 1.2700 2.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -1.4240 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -2.5440 2.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6970 -1.5250 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -0.9420 4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -1.0660 6.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 -1.7740 6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -2.3600 4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -2.2370 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 0.9300 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -1.4270 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.9540 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 2.2700 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 2.7650 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.5590 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -0.2650 -4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 1.3710 -5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 2.4880 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -3.1810 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -0.3830 4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -0.6060 6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 -1.8660 7.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5050 -2.9090 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -2.6960 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 3.1340 -5.9850 O 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 2 0 0 0 0 10 11 1 0 0 0 0 10 22 2 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 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 46 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 M CHG 1 21 -1 M END