PUBCHEM-ZINC05979580 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.8480 1.0480 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -0.3320 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -0.8290 -0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -2.0690 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -2.7500 0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -2.4800 -2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -4.0030 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -4.4290 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -2.2570 -3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -1.8210 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -4.2650 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 -4.0540 -4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6630 -4.8140 -4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9500 -4.3420 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 -3.3010 -5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 -3.0780 -5.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -2.0650 -6.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -1.8740 -6.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 -0.8030 -7.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -0.3030 -7.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 0.7910 -8.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 1.3920 -9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 0.9140 -8.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -0.1860 -7.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9040 -0.9930 -7.1520 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 2.5870 -9.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 1.7240 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 1.0050 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 1.4700 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.2700 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -1.0030 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -2.1480 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -4.3900 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -4.4640 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -5.5120 -3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -4.1420 -4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -1.9400 -4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -1.8450 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.7290 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -2.0660 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -3.8670 -5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -5.3500 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 -5.6500 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8940 -4.7240 -3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 -2.6920 -5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -0.7660 -7.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 1.1710 -8.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 1.3820 -9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 3.5050 -9.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 2.6320 -10.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.5380 -10.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -3.7640 -3.5750 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1280 -4.0580 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 52 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 52 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END