IFLAB-ZINC04059792 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9000 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0080 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7040 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.3090 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 -0.4030 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 -0.7080 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -1.3640 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3850 -1.4880 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1900 -0.8720 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8720 -0.8400 -2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7280 -1.4110 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9040 -2.0200 -3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2390 -2.0560 -1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6920 -1.9600 1.7340 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1020 -1.4700 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0940 -1.9170 4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1280 -1.0780 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0380 -1.4870 5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9140 -2.7360 6.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8800 -3.5750 5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9670 -3.1620 5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0580 -3.2500 7.5360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.9780 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -1.3340 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -1.3250 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 0.9390 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 0.9300 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -0.4580 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9590 -0.3680 -2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4800 -1.3850 -4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5640 -2.4640 -3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1560 -2.5330 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9960 -0.3860 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1370 -1.9370 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2240 -0.1030 4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8450 -0.8320 6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7840 -4.5500 6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1570 -3.8150 4.7170 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 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 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END