ASINEX-ZINC04861051 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.6090 3.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.3820 4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.2240 5.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -0.8810 6.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9810 -1.9660 6.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -0.2520 6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -0.7830 7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -0.3920 8.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -0.8700 8.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.4920 7.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -1.8160 9.7590 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -2.5410 9.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -2.4430 10.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -0.7350 10.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.3590 10.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 0.4890 11.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 0.9620 12.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 0.5820 12.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.2690 12.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 1.8230 13.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 2.3690 14.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 3.1050 15.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 3.0620 14.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 2.3090 13.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.9610 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.5720 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -1.0940 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -0.5070 5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 0.8320 6.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -1.8690 7.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -0.3520 7.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -0.8520 9.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 0.6920 8.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.5840 7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -1.0180 7.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -0.7280 9.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.7830 11.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 0.9500 13.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.5680 12.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 2.2230 15.1320 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 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 M END