IBS-ZINC02129051 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.1890 1.0090 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.3670 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.9510 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -0.1590 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 1.2170 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 1.8010 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -0.7960 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0950 0.0160 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 -1.4600 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -2.6320 -1.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5850 -0.6140 -1.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4600 0.8030 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 1.1370 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8100 0.3160 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0120 -0.9540 -1.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2470 -1.7560 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3520 -1.3820 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4920 -1.4040 -3.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -1.9020 -2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -1.4950 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -0.3530 -3.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -2.4720 -3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.1310 -5.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -3.0820 -5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -4.3700 -5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -4.7210 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -3.7780 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -4.0900 -2.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -4.9880 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -3.1630 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -3.4780 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 1.4660 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -0.9850 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.0260 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 1.8360 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 2.8760 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -0.1650 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -1.7770 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 1.4280 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 0.9400 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 2.2040 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 0.7990 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1060 0.8610 -1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6810 0.0610 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -1.1280 -5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -2.8220 -6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -5.1050 -5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -5.7270 -3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6080 -1.7390 -3.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7770 -2.0060 -3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 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 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 50 51 1 0 0 0 0 M END