IBS-ZINC02138272 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -1.1840 1.0990 O 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 0.0060 -0.6080 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.3360 -2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -1.0940 -3.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1190 -2.0890 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.1330 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -0.6820 -5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -0.3540 -6.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -0.8580 -7.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 -1.6890 -7.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -2.0160 -5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -1.5090 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -1.1500 -4.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.3310 -5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -3.3440 -4.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -2.3600 -6.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -3.5380 -7.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -3.5120 -8.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -2.3250 -8.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -1.1510 -7.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -1.1570 -6.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 0.0010 -6.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 0.8380 -6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.0280 -5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 1.0070 -4.5090 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 1.6320 -0.6950 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 0.8390 -4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -0.0220 -3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.2950 -6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -0.6020 -8.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -2.0840 -8.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -2.6660 -5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -1.7620 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -4.4640 -6.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -4.4230 -8.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -2.3190 -9.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -0.2300 -8.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.1920 2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -0.5350 3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 46 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 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 46 47 1 0 0 0 0 M END