ASINEX-ZINC04989555 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 0 0 0 0 0 0999 V2000 0.5670 1.3780 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.1150 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -0.5070 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -2.0060 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -2.4070 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -3.8160 0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -4.3840 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -5.7640 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -6.4720 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5300 -5.7990 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 -4.4200 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -3.7150 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7810 -6.5880 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7300 -7.7650 -0.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9500 -5.9370 0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2350 -6.6030 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3880 -5.6160 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7450 -6.3150 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8910 -5.3130 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2540 -5.9920 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4530 -5.0450 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1850 -3.8210 0.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 1.6350 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 1.6800 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 1.9580 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -0.6660 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.3890 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 0.0510 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -0.2260 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -2.5750 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -2.3000 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -1.8740 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -2.1560 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -6.2940 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -7.5470 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 -3.8750 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 -2.6470 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9330 -4.9870 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2880 -7.1170 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2700 -7.3650 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3040 -5.0990 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3120 -4.8450 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8280 -6.8290 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8200 -7.0800 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7990 -4.7940 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8100 -4.5480 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3480 -6.5050 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3360 -6.7540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5780 -5.6210 0.2140 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 M CHG 1 49 -1 M END