CHEMDIV-ZINC06796152 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -2.7380 1.2370 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -0.0220 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -0.6270 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -1.1320 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -2.4350 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -2.9900 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -4.3180 0.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -4.5510 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -3.6620 2.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -6.0160 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -6.5400 1.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -7.0210 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2150 -7.6470 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -8.1500 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -8.0000 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -7.3480 -1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -6.8450 -0.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2960 -7.8190 0.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 -7.0790 2.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6270 -7.8010 2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -6.5640 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 -6.1710 3.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 -5.9510 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0450 -5.6320 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9700 -4.5860 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1660 -3.8430 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4320 -4.1400 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 -5.1840 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 1.9120 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 1.7790 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 1.0000 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 0.1880 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -0.5150 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -1.0520 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.4620 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.2220 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -0.7090 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.8340 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.4470 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -3.0380 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -2.3470 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -3.0510 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -5.1290 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -6.6170 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -6.0860 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2430 -8.6530 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -8.3820 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -7.2080 -2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9040 -6.1930 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5390 -4.3530 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8910 -3.0330 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5810 -3.5590 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9470 -5.3910 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -0.9880 -0.4030 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2500 -0.9000 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 54 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 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 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 21 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 18 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 21 22 2 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END