IBS-ZINC02198301 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 3.3180 1.6650 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 0.2440 2.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.4930 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -1.8770 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.6300 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -1.9960 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -0.6120 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 0.1400 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 0.0090 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 1.4370 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -4.0270 2.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -4.6340 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -3.9750 4.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -6.1340 3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -6.6420 4.6120 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -8.3860 4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -9.0420 3.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -10.3030 3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -10.5320 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 -9.3100 5.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -9.0660 6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -8.5430 7.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -8.3040 8.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 -8.5840 8.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7050 -9.1050 7.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -9.3530 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0080 -8.2810 10.0500 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -11.8510 5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -13.0060 4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -14.2320 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 -14.2680 5.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -13.0860 6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -11.9290 6.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 1.9980 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 2.1310 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 1.9500 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -2.3700 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -2.5810 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.2180 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 1.8230 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 1.7750 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 1.8040 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -4.5580 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -6.6000 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -6.4450 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -8.3240 7.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -7.8970 9.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7630 -9.3230 7.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 -9.7640 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -12.9420 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -15.1430 4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 -15.2100 6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -13.1110 7.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 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 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 M END