PUBCHEM-ZINC03873819 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 1.6510 -0.7050 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -1.7810 -0.6970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4960 -1.7610 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -3.1380 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -3.5300 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -4.8060 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -5.7150 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -5.2380 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -4.0120 -1.7050 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4480 -6.8790 -1.6240 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0220 -1.5150 0.7820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1220 -1.5270 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -2.6490 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.1250 0.9540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0220 0.6600 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 0.1920 2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 0.1320 2.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 0.5780 3.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 0.8890 4.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5720 0.2790 5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 2.3920 4.9060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1100 2.9310 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 3.1480 4.4650 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9810 4.2070 4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 3.0180 5.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9490 3.7920 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 3.1850 6.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9140 4.2550 6.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 2.5650 6.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 2.7040 8.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 3.6040 9.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 3.2100 10.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 1.8280 10.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 1.5320 12.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 0.9220 9.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 1.3510 8.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 0.5200 7.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 1.7650 5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 1.1080 6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 2.7460 3.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 1.8830 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 0.5220 5.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 0.7780 4.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 0.2550 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -0.9840 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -0.5500 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -2.8680 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -5.1100 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -5.8430 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -3.7410 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -2.7800 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 -2.4540 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -3.6040 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 0.6470 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 4.6430 8.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 3.9130 11.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 -0.1290 9.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 0.5700 12.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -0.0490 6.2230 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9540 -0.0160 0.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -0.5510 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 0.9490 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 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 47 1 0 0 0 0 6 7 1 0 0 0 0 6 48 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 49 1 0 0 0 0 9 50 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 60 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 40 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 36 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 36 37 2 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 42 43 2 0 0 0 0 42 59 1 0 0 0 0 60 61 1 0 0 0 0 60 62 1 0 0 0 0 M CHG 1 9 1 M CHG 1 10 -1 M CHG 1 59 -1 M END