IBS-ZINC01280224 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.5280 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0020 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0190 -0.3830 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.5440 1.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8380 -1.6290 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -0.1830 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -0.6200 4.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -1.5910 5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -1.4440 5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -1.9020 6.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -2.5990 7.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -2.8730 8.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -2.4810 8.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7870 -1.7880 6.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -1.4990 6.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -0.8500 5.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -0.4670 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -0.8210 4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -0.2090 3.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1910 0.8730 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -0.5280 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 0.0700 1.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0780 1.1460 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -0.1760 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -0.4080 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.4550 -1.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -0.1640 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.4740 -1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 0.1920 0.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 0.1820 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 -2.7850 8.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 -3.4980 9.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 1.9030 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.9090 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.8600 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.9010 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.6000 2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.8560 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 0.4020 5.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -1.3490 6.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -2.6140 5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -2.9070 8.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -3.4090 9.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -1.4880 6.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 -0.0900 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.6080 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -0.5660 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 -0.8230 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 0.8750 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 0.4880 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -2.9100 10.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 -4.4520 9.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -3.6760 10.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -0.7530 3.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 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 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 54 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END