IBS-ZINC04137467 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.3870 1.7770 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 0.2820 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -0.5070 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -1.8980 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -2.5310 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -1.7330 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.3410 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.0480 -0.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2980 -4.4000 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -4.6560 -0.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2110 -5.0660 -1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -5.0960 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -5.5600 -3.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -4.5600 -1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -4.5450 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -5.7870 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 -4.8340 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 -7.2850 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -5.3970 -2.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -5.8650 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -6.6470 0.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -6.1020 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -5.7080 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 -5.9470 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -6.5790 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -6.9840 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -6.7500 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -7.6090 3.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -7.8600 4.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 2.1850 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 2.2100 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 2.0880 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -0.0410 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -2.4820 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.1760 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.2560 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -4.5340 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -3.6210 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -5.7650 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -6.6910 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -4.8310 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -3.8820 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 -5.0370 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -8.0410 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -7.3840 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -7.3610 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.9170 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -5.2350 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 -5.6460 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 -6.7440 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -7.0720 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 -6.9260 4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2750 -8.5370 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -8.3550 5.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -5.9250 -0.2280 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6180 -5.8800 -1.2060 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 55 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 55 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END