IFLAB-ZINC02722411 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0760 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7800 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0710 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6750 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.0830 -2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.2820 -1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1210 -0.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.8440 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -5.6100 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.8270 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.7190 -4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -2.4700 -5.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -1.0950 -6.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -0.6030 -6.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -0.7830 -7.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 -0.3180 -7.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 0.2900 -6.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 0.4780 -5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 0.0450 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -3.5050 -6.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -5.1120 -5.9720 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -3.2760 -7.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -4.4010 -8.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -3.8780 -10.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -3.6200 -10.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -3.1400 -12.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -2.9180 -12.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -3.1760 -12.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -3.6600 -10.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1540 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6080 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1280 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -5.9150 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -6.3580 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -5.5160 -3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -3.6490 -4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -1.8960 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -1.8970 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -3.6500 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -1.0690 -7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.4540 -5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -1.2800 -8.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -0.4540 -8.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 0.9790 -4.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 0.2060 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -2.3660 -8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -4.9960 -8.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -5.0220 -8.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -3.7940 -10.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.9380 -12.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -2.5420 -13.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -3.0020 -12.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -3.8660 -10.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 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 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 M END