IBS-ZINC05344971 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.5460 0.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -0.9100 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -1.4020 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -2.9050 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -3.3900 2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -3.9280 3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -4.3760 4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.8560 5.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -4.2860 4.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -3.7610 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -3.3000 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -2.7600 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -2.6870 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -3.1480 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -3.6750 3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 -3.0700 2.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6580 -3.4370 3.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0110 -3.1340 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 -4.9530 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9930 -2.7500 3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3890 -2.0180 3.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 -2.9490 4.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0450 -2.2820 5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6820 -2.6690 6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5850 -3.7140 6.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1650 -4.0620 7.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8140 -3.3420 8.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9040 -2.3090 8.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3750 -2.0020 7.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 -2.0180 -0.0080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 1.1200 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 0.9440 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 0.7840 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.4380 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -1.1010 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -0.8740 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -1.2110 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -3.4330 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -3.0960 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.0130 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -2.4030 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -4.0300 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3190 -5.2330 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -5.4500 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 -5.2570 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -3.5340 5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6930 -2.5850 4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9020 -1.2010 5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8350 -4.2540 5.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8740 -4.8750 7.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2460 -3.5860 9.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6250 -1.7430 9.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 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 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 M END