CHEMDIV-ZINC06877718 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.0220 1.4770 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0490 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -0.5430 0.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8980 -0.0330 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -2.0280 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -2.8000 -0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -2.4990 1.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -3.9440 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -4.2040 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -4.3160 4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.5560 5.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -4.5760 5.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.3670 3.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -0.1890 -1.3820 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -0.6090 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -1.1240 0.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -0.0780 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 -1.3230 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 -0.8940 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 -0.4420 -1.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5370 -0.9840 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3190 -1.4990 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 -1.9040 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4160 -1.8100 1.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 1.8360 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.7740 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 1.9080 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -0.4830 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -0.3500 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -1.8820 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -4.3690 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -4.4060 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -4.2380 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -4.6970 6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.7360 6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9830 -0.6600 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3890 -1.5840 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3290 -2.3050 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 24 2 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 M END