IBS-ZINC02148000 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1390 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.4800 3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -1.8560 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -2.6320 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0060 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.7520 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -3.0950 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -4.1030 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -4.8210 1.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -6.2190 1.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -6.8220 2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -8.3120 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -8.9200 3.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -9.0180 1.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -10.4840 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -11.1110 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -10.4070 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -11.3540 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -11.2080 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -12.3510 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -13.5950 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -13.7680 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -12.6260 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -12.4390 1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -13.1410 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -8.9150 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -8.4120 0.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7530 -8.7180 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -6.9190 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -6.3060 -0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.1180 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -2.3330 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -3.6720 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -3.6890 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.1840 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -4.5830 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -6.4360 2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -6.5480 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -10.7480 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -10.8290 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -10.2430 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -12.2770 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3960 -14.4600 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -14.7430 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -8.6840 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -8.4320 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 M END