IBS-ZINC06661349 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7430 -0.5120 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -2.0090 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -2.6260 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -4.3450 1.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -4.2190 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.9230 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -2.5020 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -2.1600 4.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -2.4940 2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -2.0660 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -5.2840 2.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -6.5260 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -6.7110 1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -7.5610 3.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -8.9100 3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -9.8780 3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -10.1310 5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -11.0180 6.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -11.6530 5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -11.4010 4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -10.5160 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.9050 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.5000 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -0.3200 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.0090 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 -2.1060 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -1.0440 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 -2.7250 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -5.1360 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -7.4130 3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -8.9210 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -9.2040 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -9.6350 5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -11.2150 7.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -12.3460 6.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -11.8960 3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -10.3220 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -2.1100 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -2.2400 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.1210 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5880 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.1370 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END