IBS-ZINC02339020 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 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 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -2.8180 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7810 -3.2960 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -3.5430 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -3.3090 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -2.8360 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -4.0270 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4500 -4.3030 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1820 -5.6420 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2300 -5.5450 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6010 -4.9790 -1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4310 -4.2660 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1240 -3.8890 -2.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 -4.3140 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0120 -5.0250 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1280 -5.5990 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9810 -6.2080 -2.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2020 -5.4380 -4.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2720 -4.7720 -5.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4150 -4.6730 -6.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1920 -4.1810 -4.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2020 -3.4580 -5.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3430 -6.0160 -5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4600 -5.0070 -5.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5910 -4.2360 -6.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4280 -4.8840 -4.0620 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 0.5120 -0.3560 -0.8950 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 -1.9440 -0.1820 0.9100 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 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -2.6250 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -3.4760 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -3.5010 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -2.6570 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 -4.3580 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 -3.5090 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4630 -6.4250 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6750 -5.8850 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6150 -6.5400 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -4.9010 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4310 -4.1500 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -3.0100 -6.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -2.6740 -4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0390 -6.2830 -6.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6860 -6.9080 -4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3920 -3.5130 -6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8970 -4.3240 -7.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1620 -5.6010 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3840 -3.8740 -3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4390 -5.0900 -4.4160 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 M END