NCID-ZINC05439579 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.7420 1.1970 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0850 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.5160 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 0.1790 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -0.3730 3.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 0.0040 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.5250 5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -0.0880 6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 0.7870 7.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 1.2320 6.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 0.9030 5.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -0.7340 7.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -1.5460 6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -1.4350 5.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -0.5850 8.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1460 -0.1920 9.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 0.2690 8.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6840 0.1160 7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -0.4890 9.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1470 -0.3280 9.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -1.9400 9.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1280 -2.3150 8.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -1.9050 8.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -2.8510 10.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8990 -4.2240 10.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -4.9480 9.6150 P 0 0 0 0 0 0 0 0 0 0 0 0 -7.8290 -4.0830 8.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 -0.0180 10.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 0.8700 10.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 1.5000 8.9050 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1950 -0.9040 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.7180 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 1.8790 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 0.9940 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -1.4710 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.0020 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 1.2630 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -1.0450 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 1.9510 7.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -2.1870 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -2.7110 11.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9530 -2.6330 10.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.3270 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.8260 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -1.1830 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 -6.3540 9.2010 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.1660 -4.9010 10.8780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 28 29 1 0 0 0 0 31 43 1 0 0 0 0 31 44 1 0 0 0 0 31 45 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 46 -1 M CHG 1 47 -1 M END