CHEMDIV-ZINC04950804 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 4.0360 -1.5710 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -1.3340 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -3.7440 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -4.3400 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -3.2760 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -1.9520 -1.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8390 -1.2030 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -1.3890 -1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -0.9430 -1.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -1.7290 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -2.8430 -1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -1.1660 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -1.7900 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -0.9810 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 0.2480 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 0.4070 0.4150 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 1.2640 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3880 2.5240 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 3.4250 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3110 3.0660 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 1.8120 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1770 0.9150 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7470 -0.3500 2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 -0.5890 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -1.3240 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 -2.4070 1.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 4.7870 3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -2.5650 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -1.4740 -3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -0.8350 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -1.4800 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -0.3190 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -3.8070 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -4.1620 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.4840 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -5.3040 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -3.4260 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -3.3150 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.5110 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -2.1290 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.0190 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 -2.7920 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 2.8210 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8570 3.7630 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8260 1.5520 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 5.4870 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 5.1650 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 4.7540 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -2.2800 -1.9180 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5280 -2.2000 -2.9100 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 31 1 0 0 0 0 2 32 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 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 6 8 1 0 0 0 0 6 49 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END