IFLAB-ZINC02457408 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.1790 2.1500 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.7190 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 0.3950 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -0.9450 -1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -1.9930 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -1.6600 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.3130 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.7240 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -3.3140 -1.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -4.0880 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -5.4800 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -6.1440 -1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -5.3510 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -3.9510 -2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -7.4220 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -8.0700 -1.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -8.1020 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -8.8520 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -9.5790 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -9.5700 -3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -8.8330 -4.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -8.0810 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -7.2890 -4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -6.1480 -4.3530 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8870 -1.2280 -3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 2.4610 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 2.2880 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 2.8070 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 1.1950 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -0.0690 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -3.1800 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -2.3070 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -3.4940 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -4.1920 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -3.5770 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -6.0880 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -5.3990 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -5.8550 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -5.2610 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -3.3520 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -4.0270 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -8.8770 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -10.1600 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -10.1410 -4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -8.8410 -5.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -1.9940 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -1.5560 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -0.3340 -3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -7.8120 -5.8840 O 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 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 2 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M CHG 1 24 -1 M END