IBS-ZINC02445280 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 1.2200 1.3800 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.0980 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -0.6040 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -1.9580 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -2.8140 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.3050 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -0.9470 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -0.4490 -2.6280 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -4.1840 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -4.9190 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -6.3260 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -7.0340 -2.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -6.4200 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -7.1540 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -6.5080 -5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -5.1240 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -4.3810 -4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -5.0140 -3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.3030 -2.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -6.9600 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -8.6140 0.0050 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -9.0640 -0.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -8.9490 1.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -9.1620 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -9.9470 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -10.3770 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -10.0220 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -9.2370 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -8.8120 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -7.8320 1.5790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -11.3620 -3.5430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 1.6020 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 1.6770 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 1.9320 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.0620 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.3510 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -2.9680 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -4.6220 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -8.2280 -4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -7.0760 -6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -4.6340 -6.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -3.3090 -4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -6.4360 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -10.2240 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -10.3570 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -8.9600 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 M END