PUBCHEM-ZINC06131728 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 1.0160 1.3360 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.1020 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5650 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -1.8950 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -2.8010 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -2.3370 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -1.0000 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -0.5680 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -4.1780 -0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -4.8670 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -6.1800 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -6.9390 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -8.1520 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -6.1890 -1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -6.6760 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -4.8470 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -4.3620 -2.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -6.8040 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -8.0370 2.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -8.4870 4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -10.0170 4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -12.0760 5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -12.6310 6.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -12.4510 7.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -10.9940 7.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -10.4430 6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -4.1190 2.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 1.8440 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 1.3990 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 1.8790 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 0.1100 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -2.1960 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -3.0320 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.2700 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -1.3770 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -0.2730 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -6.1550 3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -8.1420 4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -8.0940 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -10.4050 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -10.3820 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -12.1280 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -12.6100 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -13.6960 6.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -12.1280 7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -13.0760 7.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -12.7920 8.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -10.9030 8.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -10.3910 8.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -10.9630 6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -9.3740 6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -3.2130 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -10.6170 5.4680 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2990 -10.1330 5.8470 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 53 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END