IBS-ZINC02118449 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.1590 0.8180 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 1.0580 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 2.0410 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 2.2550 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 2.8180 4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 3.0370 4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 2.6900 3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 2.1260 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 1.9060 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 1.2840 1.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5180 0.2120 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.9130 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 3.4130 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 3.9220 1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 4.2790 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 5.7290 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 6.4630 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 7.7940 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 8.3940 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 7.6640 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 6.3270 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 5.6060 -1.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 6.2870 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 1.7850 1.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 0.5220 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 3.0020 3.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 3.9170 4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 3.5670 5.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -0.2470 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 0.9620 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.2320 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.0400 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 0.0600 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.6400 4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 2.9930 3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 3.0880 5.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 1.5570 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 1.6330 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 4.0370 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 4.0970 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 5.9970 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 8.3660 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 9.4340 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 8.1340 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 5.5980 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 7.1260 -2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 6.6550 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 0.3350 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 -0.2660 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 0.5340 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 4.9480 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 3.7700 5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 1.5020 1.4070 N 0 0 0 0 0 0 0 0 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 1 53 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 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END