IBS-ZINC04652797 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.1980 1.5300 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 0.0000 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.5290 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -2.0590 1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2520 -2.4370 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.5350 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9410 -2.1740 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -4.5300 1.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2890 -4.1300 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -4.1130 2.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1560 -4.4910 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -2.5850 2.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7780 -2.1630 3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -2.0480 2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -4.6900 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -6.0340 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -6.7040 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -8.0830 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -8.7930 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -8.1210 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -6.7420 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -10.5250 0.7710 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -1.9960 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -2.8630 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 -2.3690 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 -1.0070 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -0.1400 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -0.6340 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 -0.3860 -0.1030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 1.9040 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 1.9080 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 1.8690 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -0.3730 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.3380 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -0.1560 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -0.1910 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.5760 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.5380 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.0750 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -2.3400 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -5.7780 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -4.3940 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -4.3110 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 -6.1500 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -8.6070 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -8.6740 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -6.2180 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 -3.9260 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 -3.0460 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 0.9240 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 0.0430 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -4.0030 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -4.3890 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 52 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 M END