IBS-ZINC04042896 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.0350 1.0490 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 1.5620 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 2.7510 -1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 0.5910 -2.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7860 0.3310 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 0.7870 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 0.7280 -3.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 1.2710 -4.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 1.2080 -3.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8900 2.2100 -3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 0.3390 -4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 0.6790 -4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -0.1140 -5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -1.2550 -6.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -1.5940 -5.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -0.7990 -5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -2.0600 -7.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -1.6370 -7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -3.3270 -7.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 1.7980 -5.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 3.2980 -5.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 3.8480 -6.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 5.3480 -6.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 5.8980 -7.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 7.3760 -7.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 7.9330 -6.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -0.1520 -0.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.0410 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.4180 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.3980 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 1.5670 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.1520 -5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -2.4800 -6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -1.0640 -4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -2.0180 -6.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 -2.0290 -8.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 -0.5480 -7.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -3.4280 -7.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -3.3400 -8.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -4.1540 -7.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 1.6300 -6.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 1.2880 -5.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 3.4660 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 3.8080 -4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 3.6800 -7.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7810 3.3380 -6.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 5.5160 -5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 5.8580 -6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 5.7310 -8.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 5.3880 -8.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -0.3410 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 8.0740 -8.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 9.0200 -8.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 27 2 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 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 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 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 52 53 1 0 0 0 0 M END