CHEMDIV-ZINC04960439 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.6880 1.1340 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.3640 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.9440 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -2.3180 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -3.1120 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -2.5320 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.1570 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -4.6100 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -5.0080 0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -6.3090 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -7.1530 0.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -6.7100 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -5.8430 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -6.5740 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -7.9250 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -8.0020 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -9.2650 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -9.3480 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -10.6010 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -10.5060 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -9.2500 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -9.0140 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8360 -8.9600 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7000 -10.0340 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3340 -11.1620 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 -11.2190 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -10.1460 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 1.4290 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 1.4480 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 1.6070 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -0.3240 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -2.7710 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -3.1520 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.7040 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -5.0830 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -4.9240 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -4.3350 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -4.7640 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -10.1290 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -8.4640 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -9.4020 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -10.6560 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -11.4860 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -11.3910 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -10.4920 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -9.2340 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -8.3650 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 -8.0790 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -9.9930 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0110 -12.0010 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 -12.1020 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -10.1890 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -10.5390 0.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -9.7490 0.4980 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 53 1 0 0 0 0 21 46 1 0 0 0 0 21 47 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M END