CHEMBRIDGE-ZINC04755995 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.2130 1.4970 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -0.0080 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -0.6540 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -2.0310 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.7750 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.1160 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.7380 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2470 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -4.9260 1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -4.9320 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -4.3790 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -5.4930 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -5.3580 -4.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.6710 -2.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -6.4290 -1.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7380 -6.9150 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -6.9490 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -7.5700 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -8.0480 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -7.9040 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -7.2820 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -6.8000 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -8.4160 1.2410 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7660 -8.9640 2.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -8.2890 0.7160 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3670 -7.9850 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -8.5390 -3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -9.7450 -5.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -10.5230 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -3.1940 -2.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.8940 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 1.8110 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 1.8740 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -0.0780 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -2.5340 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -2.6840 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -0.2280 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -7.6830 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -8.5340 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -7.1690 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -6.3110 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -8.6660 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -7.8880 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -7.8590 -4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -8.6360 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -9.1050 -6.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -9.3120 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -10.7350 -6.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -10.6560 -3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -9.9110 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -11.4970 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -5.8860 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -9.8570 -4.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 52 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 30 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 53 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 53 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END