PUBCHEM-ZINC00726124 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.3800 1.4760 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.0160 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6570 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -2.1440 1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2520 -2.3480 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -2.6960 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -3.9240 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -3.9980 -1.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.8100 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -1.9810 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -0.6740 -1.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.4810 -3.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -1.3770 -4.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -3.4000 -4.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.7820 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -2.6580 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -3.2430 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -3.9530 3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -4.0780 3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -3.4960 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -4.8380 5.0150 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4500 -5.3530 5.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -4.9480 5.4800 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2420 0.1040 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 0.1240 3.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 0.8100 2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 1.5570 3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 0.6840 4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 2.7940 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 1.9790 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 1.7720 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.7570 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -4.7190 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -0.2390 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -4.2800 -4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -3.1820 -5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -2.1030 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -3.1450 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -4.4100 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -3.5970 3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 1.8680 4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 0.3730 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 1.2540 5.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.1970 5.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 3.4150 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 3.3630 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 2.4830 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 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 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END