PUBCHEM-ZINC04561469 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.5550 1.6260 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 0.1270 0.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3480 -0.2410 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.1680 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 0.2780 2.8410 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6740 1.3720 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -0.1180 2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 0.0070 3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -0.3230 3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 -0.7620 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -0.8660 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -0.5520 1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -0.6120 0.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -1.3390 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -2.1680 -1.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -1.0950 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -1.6560 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -1.2740 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -2.0760 -4.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -0.3270 4.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 0.1950 4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.5130 6.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -0.0410 7.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 1.1590 6.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.8810 5.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 1.4010 4.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 2.1570 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 1.8010 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 2.0860 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -1.2490 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 0.3190 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 0.3690 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -0.2280 4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 -1.0100 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -1.1640 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -0.0190 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -1.5740 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -2.7470 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 -1.2530 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -1.2260 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.4540 6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -0.6120 7.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 1.5300 7.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 2.8200 5.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 1.9960 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.2040 -5.2440 O 0 5 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 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 46 -1 M END