IBS-ZINC06645565 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0260 1.5400 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.0100 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -0.4800 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.7120 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.1750 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -1.4230 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -1.8340 4.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -1.1560 2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -0.6900 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -0.4370 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -0.6480 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 -1.1170 0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 -1.3620 2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -1.2370 0.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -0.4520 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -0.4780 -1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.4170 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -0.6370 5.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -2.5020 4.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -2.6990 5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -4.0840 6.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -5.1440 5.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -4.8870 4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -3.5090 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -6.5110 5.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -6.6250 7.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.9150 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.9050 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8900 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -0.3650 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.3400 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -0.5290 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -0.0750 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -1.7240 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 0.5700 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -0.9070 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -1.9330 6.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -2.6350 5.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -4.1160 6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -4.2810 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -5.0950 4.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -4.9120 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -5.6560 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -3.5100 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -3.2770 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -7.6010 5.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -8.4560 5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 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 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 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 24 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 46 47 1 0 0 0 0 M END