CHEMBRIDGE-ZINC04833194 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0200 1.5460 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0390 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6490 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.0310 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.7290 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.0460 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.6590 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0150 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 0.3530 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.0920 -4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 1.3070 -4.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 1.5130 -4.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 2.1160 -6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 2.9160 -6.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 3.5100 -7.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 3.3090 -8.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 2.5140 -8.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 1.9200 -7.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 1.1410 -7.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 3.9480 -9.9990 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2360 4.6480 -10.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 3.7720 -10.9030 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0130 -2.8070 -2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.9220 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.9000 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.9050 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.1060 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.5670 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -3.8090 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 0.9880 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -0.5570 -3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 1.3980 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 3.0740 -5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 4.1320 -7.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 2.3590 -9.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 0.2070 -7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -3.0040 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2160 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -3.7520 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 23 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 30 1 0 0 0 0 9 31 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 32 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 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END