IBS-ZINC02278532 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.1340 1.5720 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 0.2460 1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -0.4360 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.2080 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 1.5340 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 2.2280 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 3.6470 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 4.3940 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 5.6760 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 5.6570 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 4.4160 0.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 6.7440 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 6.5520 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 5.3210 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 4.2500 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 5.4020 -0.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 6.6110 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 6.9510 -0.3650 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 7.7880 -0.1680 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 4.1880 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 3.8040 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 2.3000 1.2090 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2880 2.5650 0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 1.1820 0.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -2.1050 2.5470 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 2.1020 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -0.2620 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -0.3290 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 2.0360 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 4.0580 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 6.5180 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 7.7280 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 4.3700 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 3.3750 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 3.6210 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 4.6160 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 2.0250 2.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 1.2380 2.8150 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 19 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 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 37 38 1 0 0 0 0 M END