CHEMDIV-ZINC03958323 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -1.1590 2.5720 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 1.1230 -0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1790 0.8130 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 1.0190 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 1.8650 1.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -0.1060 1.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -0.3850 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 0.4150 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 0.1590 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 0.3350 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9330 1.0800 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7770 2.4860 3.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 3.0380 2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 2.3990 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 0.2060 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 0.4870 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -0.5590 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -1.5300 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -1.0640 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -1.7610 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -1.5820 -0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -2.7460 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -2.5480 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.4890 -4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -4.6180 -4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -4.8070 -3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -3.8710 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 3.1930 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 2.6370 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 3.0180 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -0.7720 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -0.1470 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -1.4600 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 0.1430 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 1.4810 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 0.4900 4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -0.9090 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -0.7320 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 0.4830 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 0.7280 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2670 0.9030 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 4.1130 2.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 2.9090 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 2.5600 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 2.7860 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 1.4100 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -0.6240 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -2.4960 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -1.6660 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -3.3380 -4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -5.3470 -5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -5.6830 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -4.0260 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 0.8890 2.8290 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7900 0.7180 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 54 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 10 54 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 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 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END