CHEMDIV-ZINC06772868 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.0360 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -2.7240 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -4.0990 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -4.5290 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -3.1520 -1.2010 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 1.0620 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 1.8320 -0.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 1.4580 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 2.8690 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 3.2650 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 2.9890 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 3.3780 -5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 4.0280 -6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 4.2660 -5.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 3.9130 -4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 4.2170 -4.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 4.4040 -7.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 4.1540 -7.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2030 4.5020 -8.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4950 3.5370 -6.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 3.1280 -5.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7160 2.5690 -4.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9070 3.3030 -6.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6230 5.0830 -8.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7930 2.2900 -2.8580 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -2.2430 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -4.7740 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -5.5650 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.7640 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 1.4410 -3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 0.7570 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 2.8860 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 3.5700 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 3.3820 -4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 5.1210 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 4.3660 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1270 3.6950 -7.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1120 2.2330 -6.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5320 3.8080 -6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 4.3420 -8.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 5.7490 -8.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 5.6620 -7.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2290 3.0310 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5890 1.7080 -3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 1.6250 -2.2920 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END