IFLAB-ZINC05258971 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.6570 1.7800 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 0.7530 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -0.5680 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -1.0090 1.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -2.1720 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -3.1350 0.3760 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -2.5780 2.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -3.8210 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -4.2280 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -5.4560 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -6.2830 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -5.8820 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -4.6470 3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -6.7210 5.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -7.4760 5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -7.4690 4.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 -8.3300 6.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -9.0810 6.7330 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0460 -9.6460 5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -10.0260 7.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5540 -9.9100 8.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 -8.6690 6.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3190 -7.6550 6.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0020 -7.6430 7.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0010 -6.7130 8.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3180 -5.7950 7.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6360 -5.8080 5.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6390 -6.7410 5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 1.6810 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 2.7250 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 0.8520 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -1.3100 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4530 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -0.4630 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -2.0070 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -3.5840 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 -5.7700 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 -7.2430 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -4.3310 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -6.7590 5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -7.6960 7.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 -9.0470 6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1770 -8.9030 5.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 -9.5770 7.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7540 -8.3600 8.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5340 -6.7030 9.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0980 -5.0680 7.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8830 -5.0910 5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1090 -6.7530 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -10.9980 7.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 -8.1180 6.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 -7.2410 6.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -11.5800 8.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 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 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 51 1 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 50 53 1 0 0 0 0 51 52 1 0 0 0 0 M END