IBS-ZINC05457010 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 -0.7930 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1870 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.4260 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.5840 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.5140 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -3.2950 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1190 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7830 -1.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.2760 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.0830 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -1.1170 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -0.9390 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 0.2720 -3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 1.3070 -3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 1.1310 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -5.7950 1.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -6.9510 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3420 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.2130 3.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.7840 4.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -1.7080 5.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -1.4060 7.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.5180 7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.6060 7.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -2.9390 9.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.2650 9.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -5.2690 8.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -4.9580 7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -3.6190 6.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -3.0090 5.6680 N 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 0.0710 -3.4800 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -5.4240 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -3.2520 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.9920 -3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.6780 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -2.0640 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -1.7480 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 0.4110 -4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 2.2540 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 1.9400 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -6.9560 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -6.9310 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -7.8490 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.7140 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.1640 5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -2.1610 9.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -4.5230 10.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -6.3040 8.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -5.7450 6.5430 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 20 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 32 2 0 0 0 0 24 25 1 0 0 0 0 24 26 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 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 M END