IBS-ZINC05450791 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 0.0670 1.4730 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.0080 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.7280 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.6840 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.0180 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.6600 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.0600 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -2.7620 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -2.0760 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.7910 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -4.1410 -4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -4.8690 -6.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -6.3300 -6.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -7.0970 -4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -6.5350 -3.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -8.4380 -4.9950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -9.0590 -6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -10.2690 -6.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -8.3900 -7.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -7.0330 -7.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -6.3800 -8.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -9.1330 -8.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -9.5300 -9.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -10.3060 -10.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -10.6780 -10.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -11.4110 -12.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -4.2620 -7.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 1.8580 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.8280 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 1.8220 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.0220 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -1.3740 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -1.3360 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 1.0980 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1150 -4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -3.8420 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -2.6160 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.2480 -5.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.6840 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -8.9590 -4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -8.5050 -9.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -10.0300 -8.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -10.1580 -8.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -8.6330 -9.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -9.6790 -11.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -11.2030 -10.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -11.6550 -12.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -10.8060 -12.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -12.3310 -11.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -5.4140 -8.5230 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 1 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 27 2 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 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 22 1 0 0 0 0 20 21 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END