IBS-ZINC02340313 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.6930 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -4.0710 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -4.7180 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -6.1270 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -6.0970 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -7.3200 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -8.4450 -0.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -8.4250 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -7.2980 -1.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -7.3580 0.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -8.6460 0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 -8.4070 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -9.7520 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9950 -9.5300 2.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 -10.7280 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 -10.3710 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -4.8110 -0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -3.9600 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -2.6360 -0.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -4.8740 -2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -3.9910 -2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -2.7700 -3.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -1.9230 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -4.7130 -3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -3.6830 -1.3730 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -9.3610 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -6.5310 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -9.2210 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -9.2000 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 -7.8320 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 -7.8540 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 -10.3270 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 -10.3060 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -11.3230 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9170 -11.3020 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6100 -9.7760 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7340 -9.7970 4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4940 -11.2850 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -5.2490 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -5.7140 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -1.5400 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -1.0860 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -5.6490 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 -4.0820 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -4.9220 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -3.1610 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -3.0540 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -4.6150 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 23 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 22 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 M END