IBS-ZINC02330095 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 0 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.0790 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -0.9250 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 -0.5390 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.6930 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 1.4390 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 2.6290 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 3.5440 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 3.2440 -1.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 2.1090 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 1.2190 -0.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 4.7400 -2.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5190 5.6870 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 6.8970 -3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5090 7.9870 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 9.0780 -3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 9.0430 -5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 7.9890 -5.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 6.9370 -5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 2.6280 -2.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 1.5000 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 1.0770 -1.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -1.6080 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 -2.8740 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -2.2810 0.0260 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.5840 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 1.9030 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 4.9490 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9820 5.9940 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2650 5.2110 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 7.9860 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 9.9440 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 9.8890 -5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 6.0940 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 -1.7820 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -1.3200 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -3.4740 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 -3.4610 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -2.1740 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.9150 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 25 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END