IBS-ZINC05157520 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -0.7400 -1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 -1.2000 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -1.5440 -2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -1.5150 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -1.9140 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -2.3440 -3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4840 -2.3770 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -1.9780 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -1.9120 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -1.4570 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -1.2130 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -0.7580 1.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -1.4470 2.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -1.1870 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.5260 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -1.2540 6.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -1.5880 7.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -2.0000 7.2000 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 0.5120 -0.3560 -0.8950 H 0 0 0 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 -3.2860 -1.1800 -4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -1.8920 -5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2830 -2.6550 -4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 -2.7140 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -1.7830 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -1.8050 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -0.1350 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -0.9080 4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -2.5780 4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -1.8720 6.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -0.2020 6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -1.4270 8.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -1.6540 9.3500 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 26 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 38 39 1 0 0 0 0 M END