IBS-ZINC05033165 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.2380 0.8180 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.6990 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -1.2630 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -1.3680 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -1.8770 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -2.0080 -0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 -2.1910 -2.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -2.0160 -3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 -2.4080 -4.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -1.3850 -3.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -1.0050 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -0.3990 -2.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -1.0900 -5.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 0.2450 -5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 1.4280 -5.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 2.6610 -5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 2.7260 -6.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 1.5580 -6.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 0.3250 -6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -1.5970 1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -1.8560 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -2.5940 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.8100 3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -2.2940 4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -1.5610 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -1.3520 3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -1.0080 5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -0.4180 5.6550 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2650 1.1950 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.3130 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 1.1170 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -1.0000 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -1.1100 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -2.5950 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -1.0960 -5.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -1.8840 -5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.3970 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 3.5710 -5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 3.6860 -6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 1.6080 -7.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -0.5760 -6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -1.6990 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -3.0370 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -3.3870 4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -2.4690 5.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -0.7760 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -1.1770 7.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 2 0 0 0 0 M CHG 1 28 -1 M END