CHEMDIV-ZINC04035564 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.9120 0.7840 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.5720 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -1.0040 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -0.0460 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 1.3200 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 1.7390 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 3.1820 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 4.0440 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 3.4030 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 4.7760 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 4.8600 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 6.2530 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 6.7030 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 6.6120 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 5.2180 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -0.4560 -0.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7400 0.1390 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -0.2450 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 -1.2130 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -2.2310 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -1.9470 0.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6310 -2.0810 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.8820 -0.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4770 -3.8160 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -2.3550 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -3.3340 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -2.5200 -2.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 1.0670 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.3020 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 2.0570 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 5.4180 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 4.1170 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 4.5850 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 6.2590 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 6.9680 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 6.0760 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 7.7320 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 6.8690 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 7.3490 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 5.2030 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 4.4950 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 0.5910 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 -1.2670 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -3.2530 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 -2.0520 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -3.0150 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -4.5060 -1.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 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 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 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 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 47 -1 M END