IBS-ZINC02427551 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.1140 1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 0.0990 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.0500 3.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 0.4940 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -0.3920 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 0.5030 2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6560 -0.0080 2.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 -1.3370 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1110 -1.8930 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2680 -3.2440 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1620 -4.0930 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 -3.5940 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -2.2010 2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -1.6980 2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 1.7940 2.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 1.7970 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 2.9230 2.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 2.9980 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 3.3820 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 4.2390 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 4.5910 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6450 4.0860 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 3.2280 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2180 2.8800 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 4.4680 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.3980 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9780 -1.2480 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2620 -3.6640 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3120 -5.1620 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -4.2640 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 2.8440 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 3.8000 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 3.8140 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 2.8000 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 4.6340 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 5.2610 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3680 2.8330 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 2.2140 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 5.3640 -3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 3.6520 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 4.6650 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END