IBS-ZINC02333375 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -5.0460 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -5.5160 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -5.5440 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -5.0660 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -4.9850 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -5.3420 3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -5.2580 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -5.6220 5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -6.0790 5.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9180 -6.1740 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -5.8060 2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -5.8870 1.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 -5.8930 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -7.0430 -2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -4.9770 -2.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -5.4260 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1970 -4.2560 -3.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5820 -3.7910 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3610 -4.7380 -4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5790 -3.5740 -5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5200 -2.5260 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 -3.2840 -4.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -4.8710 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -4.9060 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 -5.5560 6.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 -6.3630 5.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8900 -6.5300 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 -5.8160 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8570 -6.2130 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0820 -5.6470 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2570 -4.9040 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4080 -3.9070 -6.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5830 -3.1640 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1130 -2.0310 -5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -1.7940 -4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -4.5370 -2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -5.0810 -3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END