IBS-ZINC00544400 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.6700 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -4.0350 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -4.5680 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -3.7030 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -2.3230 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -4.5560 -3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -5.8810 -3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -5.8710 -2.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -6.6620 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -6.9050 -4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -6.5760 -5.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -5.3130 -5.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -4.3180 -4.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -8.2360 -3.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -9.1280 -4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -10.5340 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -10.9380 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -12.2800 -3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -12.6920 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -11.7610 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -10.4250 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -10.0090 -3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -8.5410 -3.5460 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 0.5290 -0.3650 0.8850 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 -0.2500 -2.2620 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -4.6920 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -1.6560 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -5.0890 -6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -9.1470 -5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -8.7720 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -11.2380 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -10.5460 -3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -13.0080 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -13.7390 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -12.0790 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -9.6980 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -7.9630 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -8.2710 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 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 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END