IBS-ZINC04887781 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.4100 1.9000 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.7560 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 0.8540 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 0.5880 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -1.3720 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.2690 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -3.6250 -2.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -4.1630 -2.6910 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5040 -4.1100 -3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -5.6140 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -5.8000 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -4.5150 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -4.3310 -0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -6.7750 -0.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -6.6010 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -7.8840 -2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -6.4030 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -6.4230 -4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -6.2540 -5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -6.0650 -5.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -6.0470 -3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -6.2190 -2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -3.3700 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -2.6420 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.8870 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -1.8340 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -2.5710 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -3.3280 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -1.0560 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 2.6880 -2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.5470 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 2.3510 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.0880 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 0.0080 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 0.5540 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 1.9210 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 0.8820 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 1.1710 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -0.4650 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.4130 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -1.6860 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -1.8630 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -2.3330 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -8.4410 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -6.5830 -5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -6.2780 -6.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -5.9390 -5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -5.9040 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -6.2060 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -2.6660 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -1.3460 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -2.5650 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -3.8870 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -1.6920 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -0.6820 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -0.1870 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 0.0870 -1.5430 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0090 0.1000 -2.3040 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 57 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 3 57 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 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 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 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 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END