IFLAB-ZINC04569400 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -9.6550 0.9890 5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7260 -0.5280 5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1780 -0.9440 4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8730 -0.9290 3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8430 -2.4540 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 -2.8380 2.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8560 -4.1400 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3790 -4.9950 2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 -4.5320 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5010 -3.6770 0.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 -5.8340 0.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0370 -6.2180 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -7.7420 -0.3870 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4770 -8.1060 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2920 -8.3820 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -9.5630 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -8.9630 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -8.1350 -1.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -7.7170 -1.7160 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -7.6680 -3.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -6.6150 -0.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -9.0510 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -10.0790 -1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -11.1260 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -11.1460 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -10.1140 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -9.0660 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -12.1760 0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -12.1300 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2620 1.2740 6.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6200 1.2850 5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0320 1.4860 4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3480 -1.0260 5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5550 -0.4460 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2280 -2.0240 4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7850 -0.6580 5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3020 -0.5020 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8580 -0.5540 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -2.8800 4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8580 -2.8280 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6080 -2.1540 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 -6.5180 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -5.8660 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -5.7710 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -8.7460 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9720 -7.6720 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 -10.4310 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8490 -9.8170 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -9.7570 -2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 -8.3460 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -10.0630 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -11.9290 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -10.1280 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -8.2600 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -13.0090 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -11.2300 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -12.1180 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 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 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END