CHEMSTAR-ZINC04091828 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.8670 1.2370 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -0.1310 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.8640 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -2.1290 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -2.6650 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -1.9690 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -0.7160 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 0.3150 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 0.9650 -4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 0.9770 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 0.2870 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -0.1020 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 1.5810 -5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 1.5950 -5.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 2.1870 -6.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 2.2430 -5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 2.8360 -7.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 2.9060 -6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 2.3760 -5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 1.8020 -4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 1.7300 -4.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 2.4200 -5.6610 N 0 3 0 0 0 0 0 0 0 0 0 0 9.6280 2.9350 -6.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4690 1.9400 -4.6310 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.7660 0.1040 -2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -2.8900 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.3390 3.5620 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9500 1.1660 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 1.8980 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 1.7220 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -0.4390 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -3.6430 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -2.4340 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 1.4020 -5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 0.7780 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -0.8430 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -0.5540 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 2.0260 -6.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 2.5960 -6.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 3.2450 -7.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 3.3680 -7.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 1.3690 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -0.9360 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 0.3610 -1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 0.7370 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -4.0220 2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -0.0660 -2.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 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 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 26 27 1 0 0 0 0 26 46 2 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 27 -1 M END