PUBCHEM-ZINC05902837 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 0 0 0 0 0 0999 V2000 0.1870 1.7580 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 0.2810 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -0.1470 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -0.2850 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -1.3010 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -0.9310 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.1480 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 0.2340 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -0.6960 2.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -0.4320 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 0.1500 1.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -0.9350 3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -0.7530 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 -1.2050 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 -2.4410 5.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 -2.8540 6.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 -2.0400 7.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4370 -0.7980 7.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7830 -0.3950 5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3970 -0.0560 7.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7340 1.2110 7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 -2.3650 8.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 -3.6190 9.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 0.0480 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 2.0510 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 2.0020 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 2.4030 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 0.5710 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -1.1080 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 0.6880 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -1.4150 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -2.2870 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.0090 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -1.9210 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -2.4590 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -0.0740 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 0.5730 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 1.0940 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -1.1940 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 -1.4330 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 -0.2250 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 -3.1100 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8880 -3.8230 7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 0.5570 5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1630 1.1060 6.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 1.8820 7.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4980 1.6590 7.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -3.6730 9.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7720 -4.4470 8.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 -3.7120 10.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 0.3230 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -1.0020 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 0.6480 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -0.5990 -1.0980 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.2110 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -1.4970 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 54 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 54 1 M END