IFLAB-ZINC02722095 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 2.7280 0.7960 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -0.5280 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -1.3090 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -2.5010 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -2.9430 -0.2160 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5010 -2.2230 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -0.9900 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -2.9120 -2.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.6270 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -4.0870 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.0890 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -5.1000 0.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -4.8610 1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -3.8000 2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -5.8880 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -6.8440 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -7.8020 4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -7.8180 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -6.8780 4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -5.9160 3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -5.0010 3.6760 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -6.8290 2.3900 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -5.1420 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -5.5840 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -6.5700 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -7.1220 -2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -6.6850 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -5.7040 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -8.0920 -2.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 -8.6170 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 0.6430 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 1.4670 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 1.2360 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -0.9690 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -3.1020 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.4070 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -5.9710 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -8.5400 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -8.5700 5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -6.8970 5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -5.1550 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -6.9120 -4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -7.1160 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -5.3680 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -9.0560 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -7.8130 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -9.3820 -2.4050 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 M CHG 1 5 1 M END