IBS-ZINC02421864 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0660 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2520 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -5.0720 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -6.3340 0.6220 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1340 -6.3430 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -5.0700 -1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -5.0190 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -6.4300 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -7.3000 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -7.5260 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -7.9890 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -7.3830 1.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -9.0760 2.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -9.5020 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -10.5300 3.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -10.7900 3.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -9.9420 3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -8.7360 2.2330 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -11.9350 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 -12.7850 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -13.8490 5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -14.0720 6.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 -13.2320 5.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 -12.1680 4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5970 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -4.7600 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -4.2770 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -4.7840 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -6.4860 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -6.7190 -3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -7.6980 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -8.1090 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -7.2850 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -8.3180 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -9.5600 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 -9.9930 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -12.6120 5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -14.5090 6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 -14.9060 6.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -13.4100 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -11.5150 4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 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 38 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M CHG 1 10 1 M END