PUBCHEM-ZINC05311880 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.7580 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -2.1970 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -0.7600 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.5240 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -0.7620 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -1.2450 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -1.4840 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -1.2340 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -1.9390 2.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -1.9800 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -1.5710 4.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4440 -2.4230 4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -2.4250 6.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -2.8390 6.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -3.2520 6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6970 -3.2520 4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5970 -2.8350 4.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8480 -3.6950 7.0870 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.8200 -3.6960 8.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8520 -4.0590 6.5000 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -0.6060 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.0680 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -2.3490 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -2.8870 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -2.3810 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -0.1500 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.5770 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -1.4110 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -2.1040 6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 -2.8410 8.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5890 -3.5750 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 -2.8320 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 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 M CHG 1 21 1 M CHG 1 23 -1 M END