IBS-ZINC05208075 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.3770 1.1640 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.2230 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.4880 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -2.0020 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -3.9290 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -4.2670 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -3.8360 3.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -4.2590 4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -5.1800 5.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -5.3480 6.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.6280 7.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -3.7110 7.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -3.5280 5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -2.6890 5.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.8930 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -2.2550 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -4.8050 8.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -4.3470 9.6450 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -4.6310 11.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -4.8560 8.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -2.5770 9.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 1.3100 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 1.5000 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.7500 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 0.0270 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.1390 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -2.3150 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -2.4750 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -4.0380 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -4.5600 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -5.3480 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -3.7620 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -5.7450 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -6.0640 6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -3.1420 7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -2.6640 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -1.1720 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -4.6200 9.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -2.1950 9.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -2.1620 9.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -2.3240 8.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -2.4960 1.2620 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1170 -1.8660 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END