CHEMBRIDGE-ZINC01178009 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 2.4930 0.5610 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.8670 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -1.7710 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -3.0970 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -3.5320 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -2.6430 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -1.3090 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.3580 -2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.7500 -3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 0.4330 -4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 1.5470 -4.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 0.0660 -5.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 0.8970 -6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 0.2840 -7.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 1.0260 -9.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 2.4010 -9.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 3.0220 -7.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 2.2710 -6.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 3.1100 -10.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 2.4270 -11.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 4.4670 -10.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 5.3740 -11.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 4.9890 -12.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 5.9240 -13.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 7.2540 -13.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 7.6530 -12.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 6.7280 -11.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 7.1950 -9.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 6.3000 -8.7830 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2720 0.8050 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 1.2390 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 0.7400 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -1.4460 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -3.7910 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -4.5670 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -3.0270 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -1.5350 -3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -1.0980 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.9070 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -0.7800 -7.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 0.5190 -9.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 4.0820 -7.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 2.7960 -5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 4.9560 -9.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 3.9640 -13.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 5.6080 -14.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 7.9800 -14.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 8.6960 -11.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 8.4160 -9.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 49 2 0 0 0 0 M CHG 1 29 -1 M END