CHEMBRIDGE-ZINC04821384 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 0.1050 1.4660 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 0.0450 0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -0.5720 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -1.9490 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 -2.5760 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -1.8280 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 -0.4490 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 0.1760 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -2.4620 0.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8730 -1.4880 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -2.1940 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 -3.3450 0.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -4.2950 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -3.5060 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4910 -3.5260 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6890 -4.9210 2.6600 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.5670 -2.5210 1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1960 -2.0770 2.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2000 -1.1390 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5900 -0.6330 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9680 -1.0720 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9580 -2.0060 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5810 0.2910 1.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9320 0.7680 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0420 1.7810 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7420 3.1210 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7600 4.0500 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0780 3.6380 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3790 2.2980 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3610 1.3700 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.8300 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 1.9210 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 1.7320 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -2.5310 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -3.6490 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3850 0.1340 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 1.2480 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 -1.0540 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -0.6990 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0220 -1.5030 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1610 -2.5390 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -4.9930 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 -4.8410 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -4.1810 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -3.0440 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8940 -2.4700 3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6860 -0.7950 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2750 -0.6770 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4730 -2.3440 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0630 1.2350 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2670 -0.0670 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7110 3.4420 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5250 5.0960 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8740 4.3640 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4100 1.9770 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5960 0.3240 0.0360 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 23 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 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 M END