IBS-ZINC04889062 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.1200 1.5760 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 0.0750 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.6170 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -2.0120 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -2.7220 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.0530 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.6490 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.8470 -2.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3930 -2.2720 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -4.1910 -2.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7200 -3.9660 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -4.9080 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -6.1160 -1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -4.1210 0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -6.2550 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -7.2480 -4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -6.5800 -6.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -5.3750 -6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.4010 -4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -2.9340 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -2.0580 -3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -2.0990 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -3.0080 -3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -3.8640 -2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -3.8240 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 1.9480 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.9560 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 1.9790 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -0.0700 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.5260 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.1110 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -4.6000 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -6.7600 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -5.8080 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -8.0590 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -7.7060 -4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -6.2610 -6.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -7.2980 -6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -4.8580 -7.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -5.7140 -6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -3.9740 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -3.6000 -5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -1.3280 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -1.4180 -5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -3.0400 -4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -4.5600 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -4.4940 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -5.1130 -3.6470 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4110 -5.5400 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 48 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END