IBS-ZINC01758260 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9630 1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.5720 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -1.9080 3.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -4.0440 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -4.6780 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -6.0520 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -6.8100 2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -6.1840 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -4.8100 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -8.1650 2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -8.8690 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -9.2660 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -9.9390 -0.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -10.3380 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -9.9560 0.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -9.3200 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -9.1100 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -8.4120 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -8.2180 4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -8.7180 4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -9.4140 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -9.6080 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -10.2860 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -8.5240 5.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -7.7990 6.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 -7.6820 7.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -9.0060 -0.0580 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -4.0900 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -6.5430 4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -6.7760 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -4.3240 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -8.0230 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -7.6760 5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 -9.8010 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -11.2400 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -8.3260 7.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -6.8020 6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -7.1560 7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -8.6790 7.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -7.1290 8.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -9.8230 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -8.9380 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -8.0700 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 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 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 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 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END