IBS-ZINC02242530 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0090 1.3730 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0060 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.6820 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.0210 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 1.4000 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 2.0870 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 3.5660 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 4.3660 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 5.6360 0.0870 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8000 5.6690 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 4.4040 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 4.3810 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 5.7910 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 6.6470 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 6.8110 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 7.3010 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 6.7240 -2.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 8.3790 -1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 8.8920 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 8.0320 -3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 8.5400 -5.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 9.9060 -5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 10.7650 -4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 10.2600 -2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 10.4010 -6.4340 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.4180 -0.0500 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.8990 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -0.5600 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -0.5120 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 1.9480 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 4.0340 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 3.6300 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 4.1740 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 5.8260 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 6.1080 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 7.0690 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 7.4390 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 6.5430 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 7.6000 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 8.7990 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 6.9670 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 7.8720 -5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 11.8290 -4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 10.9300 -2.0010 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 9 1 M END