CHEMBRIDGE-ZINC02973686 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.2200 1.5320 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0210 0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0000 -0.4800 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -0.3550 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -0.7540 1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.1950 2.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.4790 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.2040 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 0.1680 4.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -0.4130 6.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.2050 7.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -0.5160 8.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -0.8830 8.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.3580 9.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -0.5520 10.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -0.0580 9.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.4920 -1.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -0.6300 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -0.3630 -2.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -1.1640 -3.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2980 -2.0740 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -0.0800 -4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -0.4720 -5.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.1770 -6.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -0.1950 -7.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -1.2160 -7.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -1.8650 -6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -1.4930 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -1.6110 -8.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 -1.0620 -9.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 2.0440 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 1.8190 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.9130 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 0.1310 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -1.5280 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 0.1660 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -0.7230 6.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 0.8370 7.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -0.8660 7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -0.7540 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 0.8520 -4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 0.1670 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.9850 -6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 0.3240 -8.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -2.6530 -6.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -2.0030 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -1.5800 -4.6430 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8100 -0.8100 -4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.3660 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -1.8530 -5.5040 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 17 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 47 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 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 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END