IBS-ZINC05025674 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.9320 -4.6590 -3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -4.0510 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.8200 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -1.7170 -2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -1.7520 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.8630 -1.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2190 -0.8780 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -2.3870 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.4960 1.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -0.4030 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.4800 2.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 0.2560 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 1.0150 4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.1730 5.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 2.6590 6.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 2.0080 6.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 0.8520 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 0.3760 4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -0.7220 4.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -1.3730 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -0.7960 3.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -1.7590 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -2.6910 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 2.3930 7.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 3.5590 8.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -3.9740 -3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -4.9170 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -5.5800 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -3.8690 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -4.7000 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -2.6990 -4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -3.8050 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -1.8910 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -0.7490 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -2.6280 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -0.8560 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -2.4630 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -3.3860 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.3120 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 2.6850 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 3.5550 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 0.3440 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 4.4410 7.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 3.4220 8.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 3.7260 9.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -2.7170 -2.3150 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4530 -2.1480 -2.8240 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 29 1 0 0 0 0 2 30 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 46 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END