IBS-ZINC04981533 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 1.6840 -2.9430 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.6320 1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.8090 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -1.1000 3.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -0.7010 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 0.8190 1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 1.3040 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 2.7590 1.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 3.7400 2.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3540 3.6030 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 5.1050 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 4.8810 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 3.4110 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 2.8780 -1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 5.7400 -0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 6.3260 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 7.4670 1.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 6.3850 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 5.6280 4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 5.6870 5.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 6.4920 6.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 7.2480 5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 7.2020 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 8.0370 6.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 8.0410 8.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 3.5880 3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 3.5040 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 3.3660 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 3.3160 4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 3.3990 3.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 3.5370 2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -2.5690 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.0210 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -2.4600 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -2.9940 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -3.1260 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 0.2540 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -1.3880 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -2.1630 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -0.8240 3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -0.5210 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -1.1660 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -0.9630 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.0870 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.2880 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 1.0360 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 0.8350 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 8.2710 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 4.9980 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7660 5.1010 6.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 6.5330 7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 7.7930 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 8.7100 8.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 7.0310 8.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 8.3830 8.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 3.5460 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 3.2970 6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 3.2080 5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 3.6060 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -1.1810 1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 60 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 60 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 48 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 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 M END