IBS-ZINC04301894 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 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 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.7580 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -2.1970 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -0.7590 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -1.2400 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.4850 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -1.2520 3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -0.7730 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -0.5310 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -1.5200 4.9430 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8200 -2.2010 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -0.2040 5.5230 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6700 0.4780 5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 0.4320 4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 1.7510 5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6880 1.4840 6.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 0.8360 7.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -0.4820 6.8610 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1990 -1.1480 7.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -2.4370 7.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -3.3230 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -3.7740 6.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -3.1590 7.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -4.8600 5.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -5.3120 6.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -6.7890 7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -7.5910 5.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -7.0900 5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -5.6190 4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 -1.3540 6.6500 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 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 -3.1420 -0.6060 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.0680 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -2.3490 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -2.8870 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -2.3810 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -1.4220 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -1.8580 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -0.5920 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.1620 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 0.6260 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 -0.2440 4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 2.4280 5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7280 2.2060 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0390 2.4260 6.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 0.8150 6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 1.5060 7.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 0.6440 8.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -0.4710 7.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -1.3840 8.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -2.9060 7.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -3.1190 7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -3.0880 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -4.1190 5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -5.1930 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -4.7220 7.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -7.1630 7.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -6.8950 7.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -7.4650 5.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -8.6470 6.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -7.6770 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -7.1920 5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -5.2320 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -5.5260 3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -1.5740 7.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -2.1260 5.8860 N 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 72 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 72 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 72 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 71 1 0 0 0 0 M END