IFLAB-ZINC02685820 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -1.8290 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -2.2870 -2.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0530 -2.2980 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -3.6950 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -4.1690 -4.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -5.4140 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -6.1620 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -7.4270 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -7.9480 -5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -7.2000 -6.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -5.9330 -5.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -5.1180 -6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -5.9160 -7.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -3.8170 -7.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -4.7920 -5.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -9.1940 -6.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -9.9080 -5.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.3870 -3.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -1.8190 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -2.5160 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -4.3640 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -3.6680 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -5.7560 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -8.0100 -4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -7.6070 -7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -6.1480 -8.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -5.3260 -8.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -6.8430 -7.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -3.2480 -6.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -3.2270 -7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -4.0490 -7.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -5.7190 -5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -4.2030 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -4.2240 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -10.8840 -5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -10.0400 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -9.3450 -5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -1.3270 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 0.1650 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 49 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 49 50 1 0 0 0 0 M END