CHEMDIV-ZINC06799972 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -1.2230 -0.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2170 1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -0.7240 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -0.2380 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 0.8980 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 1.1360 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 0.1930 4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -1.0860 3.8240 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.2230 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 0.4520 -2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.7940 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.7080 -4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -1.3260 -5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -2.0530 -5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -2.1570 -3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -1.5320 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -1.4290 -1.2340 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 0.3410 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -0.3630 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -1.8140 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 1.5820 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 2.0190 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6930 0.2100 5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.1480 -5.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -1.2510 -6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -2.5370 -5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -2.7220 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 M END