IBS-ZINC01800428 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -2.4670 -0.4530 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.9410 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7000 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.1470 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.8360 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0790 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -1.6370 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -2.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6550 -2.3390 -3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.8560 -3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -3.9450 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -3.5970 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -4.3090 -3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 -3.6450 -4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 -2.3300 -4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -1.6010 -4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -2.2500 -4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.8380 -3.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -0.9550 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -5.2450 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.9720 -1.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8640 -4.3920 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -6.2800 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -6.7260 -1.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -0.8870 1.3500 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4920 -0.2800 2.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -1.2810 0.8700 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6800 0.5510 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -1.1250 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -0.4330 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.1620 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -2.1830 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -5.3340 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 -4.1630 -4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3370 -1.8580 -5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -0.5770 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -5.9760 -3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -5.6220 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -1.8800 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -4.2150 -2.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -4.2370 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -6.9510 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -7.7860 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -1.1900 -1.9270 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 40 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 20 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 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 39 44 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END