PUBCHEM-ZINC02979628 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.6130 1.7790 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 0.3700 -1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.5340 -2.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -1.8710 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.7210 -3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -4.1100 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -4.6640 -2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -3.8160 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -2.4260 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -6.1170 -1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -6.8800 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -8.3910 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -8.7430 -0.3450 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6210 -6.3440 -0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -7.0530 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -8.2680 0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -6.2210 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -6.7310 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -5.9770 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -4.7070 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -4.2160 2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -4.9680 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9070 -3.9120 4.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 2.0060 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.8840 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 2.5150 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 0.2890 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.1650 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -2.2990 -4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.7530 -3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -4.2350 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.8100 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -6.5760 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -5.3440 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -7.7150 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3510 -6.3880 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -3.2470 3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -4.5720 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -4.1580 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -2.8370 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -4.1230 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -9.0530 -2.0640 O 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 42 2 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 13 -1 M END