PUBCHEM-ZINC01286850 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0030 1.3550 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.1540 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.4990 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.2180 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -1.0200 2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.6980 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -1.7680 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 0.6720 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -0.6170 3.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.1740 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 0.7710 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.1190 6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 0.5510 7.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.3450 7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -0.7360 5.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 2.1100 6.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 1.9600 8.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 2.8830 8.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 3.9820 7.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 4.1600 6.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 3.2350 6.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.7860 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.7760 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.5770 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 1.9090 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -1.5620 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 0.0580 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 0.8570 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -2.0920 2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.8460 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -1.7830 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -1.5780 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -2.7720 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 1.4770 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 0.9410 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 0.6640 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.3090 3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 1.2130 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -0.8000 7.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 1.1090 8.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 2.7440 9.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 4.7020 8.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 5.0240 6.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 3.4220 5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -0.3920 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -1.8740 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.5770 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.7750 -0.2400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7680 -0.4200 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -1.7770 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 48 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END