IBS-ZINC04028360 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 0.2980 0.1720 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 0.8490 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 1.6990 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 3.1610 3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 4.0920 4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 5.4200 4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 5.8530 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 4.9650 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 3.5930 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 2.5900 1.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6490 2.6810 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 2.8640 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 2.6240 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 1.4050 0.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 1.2870 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 3.7910 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 4.1900 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 5.3150 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 6.0400 -0.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 5.6190 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 4.5090 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 5.2670 1.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 6.6320 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 7.2020 3.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 7.5590 4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 6.4280 5.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.8540 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 0.3750 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 0.3370 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 1.0790 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -0.2150 3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 1.4480 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 1.4840 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 3.7880 5.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 3.8790 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 2.1950 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 0.3230 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 3.6490 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 5.6790 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 6.2200 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 4.2200 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 6.6750 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 7.2350 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 7.0310 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 8.0340 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 8.2810 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.1040 1.6270 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6190 0.8770 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 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 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END