IBS-ZINC03985224 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.6930 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -0.5040 -2.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -1.1820 -3.5530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2070 -1.3800 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -1.1080 -2.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -1.2270 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.6750 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -0.4500 -0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -1.7670 -4.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.1740 -4.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5900 -0.0350 -4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -0.6840 -5.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 0.1020 -6.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -0.7270 -7.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -0.4640 -9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -1.5290 -9.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -2.7970 -9.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -3.0750 -8.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.0230 -7.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -1.9580 -6.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -2.7020 -6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -1.3260 -11.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 -2.4530 -11.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 1.5680 -6.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 2.0430 -5.4680 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 0.2760 -2.1340 -3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 0.5200 -9.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -3.5920 -10.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -4.0660 -8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 -2.8270 -12.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -2.1540 -12.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -3.2380 -11.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 1.7130 -6.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 2.1300 -7.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 3.0390 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 2.0750 -5.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 1.1130 -4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 1.5200 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 45 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 27 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 45 46 1 0 0 0 0 M END