IBS-ZINC01451553 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.5040 0.8660 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 0.6800 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 2.8000 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 3.2770 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 4.8000 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 5.2690 3.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 5.5320 5.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8240 6.3130 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 5.9930 5.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 5.9860 4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 5.5400 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 5.4330 1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 6.3350 4.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 6.3760 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 6.6190 6.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 6.4640 7.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 6.6900 9.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 6.6970 9.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 6.8730 11.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 6.8210 11.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 6.5950 10.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 6.4190 9.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 6.4670 8.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 6.3290 7.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 4.2710 5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 4.1860 6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 3.0220 7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 1.9830 7.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 2.1410 6.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 3.2640 5.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.2200 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 1.1510 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 1.3150 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 0.9020 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -0.3970 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 1.0480 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 3.2590 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 3.0850 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 2.9920 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 2.8180 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 5.0790 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 5.2550 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 6.2680 3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 6.8350 9.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 7.0500 11.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 6.9570 12.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 6.5570 11.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 6.2430 8.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 5.0160 6.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 2.9270 7.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 1.0620 7.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 1.3360 6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 1.3380 1.6030 N 0 0 0 0 0 0 0 0 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 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 M END