PUBCHEM-ZINC05457795 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -2.5400 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -1.7500 3.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -3.8640 2.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -4.3280 3.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -5.6130 3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -6.0820 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -7.4080 5.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 -7.4020 6.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -6.1060 7.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -5.3170 6.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 -5.6130 8.3040 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4710 -6.4200 9.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -4.4200 8.5220 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -4.4960 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -6.3160 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -8.2760 4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -8.2690 7.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END