IBS-ZINC00552924 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 2.2900 1.4180 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.0500 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.5730 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 0.1710 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 1.5400 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 2.1770 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 3.6360 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 4.2980 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 5.7170 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 6.4920 0.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 6.0800 0.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 5.2090 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 3.6580 -0.2630 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 5.4510 0.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 6.7560 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 6.9720 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 8.2600 1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 9.3370 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 9.1220 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 7.8340 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 10.6050 1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.0420 -1.1910 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1850 -2.7000 -0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -2.5940 -1.7600 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1100 1.9020 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -0.5380 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -0.3230 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 2.1190 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 4.1820 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 4.7180 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2430 6.1340 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 8.4290 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 9.9610 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 7.6660 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5090 10.9290 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END