IFLAB-ZINC04554445 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -2.8410 0.9170 6.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -0.4810 6.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -0.8610 7.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -2.3600 7.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -3.1520 6.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -3.5750 6.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -3.3490 7.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -4.4000 5.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -4.7250 4.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -4.7190 5.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -5.4530 4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -6.9710 4.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6530 -7.0860 4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -7.6450 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -7.6790 5.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -8.3270 7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -8.9350 7.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -8.9070 7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -8.2710 6.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -9.5680 8.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -10.0230 9.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -9.6190 9.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -7.0830 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -7.8380 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -9.2340 0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -9.8120 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -9.1770 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 1.1460 5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 1.4810 6.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 1.2100 5.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -0.6040 7.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -0.3150 8.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -2.6280 8.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -2.6420 7.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -3.3980 5.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -4.4080 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -4.9670 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -5.2860 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -7.2050 5.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -8.3540 7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -8.2690 6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -9.6190 10.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -11.1170 9.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -6.0330 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -7.1840 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -7.4590 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -7.6920 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -10.8820 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -9.7050 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -9.3090 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -9.6040 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -7.6600 3.1440 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2410 -7.5260 3.0720 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 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 52 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END