IBS-ZINC00549173 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.6390 -1.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -0.4550 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -1.1030 -2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -1.4380 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -1.8820 -4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -1.9970 -5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -1.6710 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -1.2190 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.8330 -2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.3640 2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -1.1660 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -1.3160 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -1.7930 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -2.1260 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -1.9780 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -1.4960 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 -2.5960 1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 -2.9180 -0.0440 C 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 4.4190 -1.3500 -2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 -2.1420 -5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -2.3460 -6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -1.7640 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -1.0590 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -1.9100 3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -2.2380 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -1.3770 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -2.0270 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 -3.6910 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8840 -3.2820 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END