NCID-ZINC05836659 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 0.6230 0.8520 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.6400 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -1.3680 0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -1.1610 0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.6060 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -3.0090 0.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9190 -2.4850 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.5320 -0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0900 -4.7520 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -5.0180 1.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5770 -5.3980 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -3.7160 1.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1630 -3.7710 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -2.6920 1.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -3.4660 0.9470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -2.5020 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -2.2720 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4960 -3.0380 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5320 -2.8490 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4370 -3.9780 0.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2230 -4.5070 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -4.1900 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 -5.0450 2.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -6.0240 0.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -6.9490 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -6.9190 2.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -8.0260 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -5.1800 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -6.6410 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -7.1340 -0.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -7.3940 -0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -8.7940 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 1.0840 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 1.3350 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 1.2150 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -2.9440 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -3.0640 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -1.9280 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 -1.5140 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -8.6090 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -8.6790 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5190 -7.5670 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.6860 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -5.0780 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -9.2870 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -9.2750 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -8.8700 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 45 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 M END