IFLAB-ZINC05145463 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.8390 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.5660 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -2.4160 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 -3.7370 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -4.0270 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -2.9090 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -1.4900 0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -2.9350 0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -1.7810 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 -0.7200 0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8640 -1.8090 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4010 -0.3770 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3720 -2.5330 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3480 -2.5470 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -5.3970 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -5.9710 1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -6.0190 -1.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 -7.2770 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -7.8500 -0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -7.8990 -2.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 -9.2520 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -4.8000 -0.0060 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 -3.7840 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0560 0.1490 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4900 -0.3970 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0380 0.1390 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9900 -3.5540 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4620 -2.5540 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0280 -2.0070 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9850 -2.0320 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4370 -2.5680 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9650 -3.5680 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -5.5620 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6700 -9.6350 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -9.8890 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 -9.2500 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -5.0620 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -5.6840 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -4.4220 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END