IBS-ZINC05454657 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.6170 1.1930 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -0.2890 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.9200 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -2.2800 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -3.0120 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.3820 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -1.0150 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.3260 -2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -3.1220 -2.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -3.2630 -2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -2.7570 -2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -4.0460 -4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -4.2330 -4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -4.8110 -6.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -5.1200 -6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -5.7660 -8.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5780 -6.6800 -8.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -6.0870 -8.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -5.3020 -10.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -5.0780 -10.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -4.8500 -8.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -4.6210 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -5.2790 -5.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -4.3980 -3.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -3.6690 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -3.5010 -2.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.3680 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 1.6050 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 1.6770 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -0.3500 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -2.7700 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -4.0740 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -0.3410 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.8440 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 0.7070 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -3.9160 -4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -5.0230 -6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 -5.8080 -6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -4.2000 -7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -7.1570 -9.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -5.7410 -8.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -5.8960 -11.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 -4.3510 -10.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -5.9650 -10.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.2060 -10.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -4.7690 -4.1200 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 M END