IBS-ZINC04818551 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.5680 -6.6700 -5.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -6.1250 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -6.9850 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -6.4410 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -5.1260 -1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -4.3320 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -4.8190 -3.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -2.9560 -2.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -2.1210 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -2.6220 -4.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -1.8010 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.5960 -5.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.3590 -7.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -1.5060 -8.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -2.0280 -9.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -3.4030 -9.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -4.2550 -8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -3.7400 -7.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -3.9150 -10.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -5.3360 -10.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.7730 -3.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -0.2260 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 1.3020 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.8680 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 2.7700 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 3.0070 0.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 3.6120 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 2.2400 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 1.5660 0.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -7.3380 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -6.8820 -5.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -5.9350 -6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -7.5890 -5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -8.0550 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -2.5860 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -0.4370 -8.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -1.3690 -10.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -5.3230 -8.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.4030 -6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -5.6120 -12.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -5.7920 -10.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -5.6900 -10.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -0.1760 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.5910 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -0.5420 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 1.6640 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 1.6200 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 3.2210 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.1960 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -7.5570 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -6.8370 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -8.2680 -0.8080 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 30 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 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 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END