PUBCHEM-ZINC05736479 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 7.3350 -5.5790 8.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -5.5160 6.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -5.1550 6.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -5.0920 4.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -4.7470 4.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -3.4460 4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -2.5660 4.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -3.1270 4.6980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0280 -2.3300 7.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -4.3150 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -4.1640 4.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -5.5470 4.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -5.7300 4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -6.8730 4.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.2440 5.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -2.6380 7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -1.9520 7.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.8660 4.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -0.6960 4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.3880 3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -0.2260 3.1260 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9550 0.9300 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 0.6800 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -0.6610 3.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -1.1450 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 -1.1820 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -6.3380 8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 -5.8360 8.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 -4.6090 8.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 -4.7580 6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -6.4860 6.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -5.9140 6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -4.1850 6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -4.3340 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -6.0620 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -6.3220 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -3.7190 7.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -2.2370 8.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -2.2610 6.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -0.8710 7.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.6870 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 0.0540 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -1.6160 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 0.1260 5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 0.5320 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -1.2100 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 1.8930 3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 1.3990 3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -2.2200 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.1600 5.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -2.5610 3.7810 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 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 8 51 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 50 2 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 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 24 26 1 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 21 1 M END