IBS-ZINC02131968 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0790 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0660 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2550 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -4.9570 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -6.3610 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -7.0050 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -6.2340 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -4.9060 0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -6.9020 2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -8.1160 2.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -6.1650 2.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -6.8260 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -5.7690 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -6.4600 6.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -5.4480 6.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -4.9030 8.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -4.0200 8.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 -4.0260 7.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 -4.8830 6.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -6.8150 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -8.0700 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -8.1680 -3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -7.0230 -4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -5.7750 -3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -5.6550 -2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -4.5560 -2.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -3.6330 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6210 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5980 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1390 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -8.0840 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -5.1960 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -7.4610 4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -7.4360 3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -5.1340 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -5.1590 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -7.0950 6.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -7.0700 5.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -5.1350 8.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -3.4130 9.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9330 -5.1030 5.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -8.9630 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -9.1400 -4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -7.1100 -5.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -4.8900 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 24 50 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 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 M END