IBS-ZINC02326928 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 2.5650 0.9800 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -0.3710 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -0.9540 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -0.1750 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 1.1830 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.7640 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 2.0060 -2.1130 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3050 1.4390 -3.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 3.2190 -2.0220 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3240 -2.3750 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.9020 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -2.2020 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -1.0140 -0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -3.2690 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -3.2160 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -4.4270 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -5.6370 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -5.6810 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -4.4660 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -4.2820 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -6.9620 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -8.5850 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -9.0250 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -9.4960 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -8.4320 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -7.9870 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -6.8180 -0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 1.4220 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -0.9620 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.6240 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 2.8160 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -3.0380 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -2.2750 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -4.4170 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -6.7870 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -7.7600 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -9.4130 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -8.1570 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -8.1910 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -9.8320 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -9.7370 -3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -10.4180 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -7.5650 -3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -8.8220 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -7.1530 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -8.8050 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 -6.6340 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -7.5110 -0.9110 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0020 -6.7290 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 48 1 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 48 1 M END