IBS-ZINC04870385 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.6460 1.0580 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 1.7880 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 3.4160 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 3.6400 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 5.0530 0.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 5.9530 -0.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1470 5.9690 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 7.3100 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 7.1050 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 5.6670 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 5.1830 2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 7.9130 1.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 8.4780 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 8.5220 -1.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 9.7800 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 10.7290 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 11.9860 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 12.2990 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 11.3640 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 10.1080 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 13.8520 0.7800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 5.4860 -1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 5.3340 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 4.8920 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 4.5900 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 4.7330 -4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 5.1800 -2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 4.4660 -4.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 4.0940 -6.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 0.0400 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 1.4230 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.0810 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 2.1280 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 0.7310 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 2.3850 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 3.7590 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 3.9580 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 3.2400 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 3.1130 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 9.4250 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 10.4980 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 12.7140 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 11.6060 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 9.3860 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 5.5560 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 4.7810 -3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 4.2480 -5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 5.2950 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 4.8840 -6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 3.9570 -6.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 3.1420 -6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.9510 1.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4130 1.6190 2.2910 H 0 0 0 0 0 0 0 0 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 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 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 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 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 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 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 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END