PUBCHEM-ZINC00238589 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.4110 1.0940 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.3540 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.8340 1.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -1.4860 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.9680 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.6770 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -0.0650 0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -1.2620 2.3470 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4240 -2.2870 2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -0.4250 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -0.9900 4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -0.9870 4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -1.2520 2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 -1.9350 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 -2.7270 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -4.1040 4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7200 -4.8310 5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 -4.1820 6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1260 -2.8060 6.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -2.0780 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8420 -4.9600 7.2500 N 0 3 0 0 0 0 0 0 0 0 0 0 8.9210 -6.1730 7.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2790 -4.3880 8.2330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4580 1.7190 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.4510 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 1.1420 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -0.9790 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.4020 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -1.3910 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -1.0100 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -3.0620 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -3.4430 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -3.4520 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 0.6080 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.4660 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -0.3730 5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -2.0110 4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 0.0360 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -1.4020 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -1.8590 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -0.2280 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8590 -0.9450 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 -2.4500 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 -4.6100 3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7900 -5.9060 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5130 -2.2980 7.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4780 -1.0030 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -1.8020 3.2660 N 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 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 48 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 48 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 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 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 46 1 0 0 0 0 20 47 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