IBS-ZINC05047150 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -2.0410 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.4760 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.4980 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.4800 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -3.8350 -2.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -4.1260 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -3.3030 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -3.8530 -4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -5.2260 -4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -6.0600 -4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -5.5150 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -6.1110 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -7.3840 -2.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -7.7630 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -8.7450 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -9.1240 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -8.5360 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -7.5600 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -7.1780 -2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 -8.9140 0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -8.2710 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -4.9550 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -5.0100 -1.6900 O 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 1.7540 -0.1020 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.1990 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -2.4060 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -2.4520 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -2.0770 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -3.5650 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.1500 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -0.1080 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -2.5020 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.8300 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -2.2310 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -3.2070 -5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -5.6440 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -7.1310 -4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -9.2020 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -9.8800 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -7.1070 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -6.4250 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 -8.6650 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -8.4590 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 -7.1970 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -1.9660 -1.2540 N 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 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 52 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 M END