CHEMBRIDGE-ZINC04645988 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0700 0.5120 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.9700 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -1.6140 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -1.6720 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -1.1210 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -0.2020 0.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 0.1890 0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 1.2200 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 2.1940 1.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 1.0920 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 1.5090 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5050 1.1640 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5370 1.6300 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7090 1.0360 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3580 0.2310 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 0.3160 0.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2860 -0.5900 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8030 -1.3660 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6750 -2.1310 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0290 -2.1330 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5140 -1.3660 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6530 -0.5920 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8790 -2.8860 -2.3850 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 0.4950 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7740 0.7490 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 -0.3360 -1.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -0.4890 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -1.6080 -1.4830 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 0.9710 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 0.6080 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.0120 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.0660 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -1.5180 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.6700 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -1.1140 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -2.7420 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -1.5000 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 2.2300 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 2.0980 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 2.3200 3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7030 1.1790 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 -1.3660 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3030 -2.7310 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5700 -1.3720 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0320 0.0080 0.9570 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 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 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 M END