PUBCHEM-ZINC03874475 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 54 0 0 1 0 0 0 0 0999 V2000 -0.0800 1.1010 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.3150 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.9610 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.1790 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.2060 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 1.8870 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 3.3810 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 3.9940 -0.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5760 5.0280 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 3.2160 0.2620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6040 1.7920 -0.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8220 1.8200 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 2.8070 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 5.1400 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 5.6590 -3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 6.4240 -4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 5.0570 -5.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 0.6560 0.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8460 0.6270 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -0.5580 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 1.1330 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6670 0.5500 0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 2.3890 1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 3.1630 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 3.8940 -0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.3150 0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 1.5660 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.9100 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 3.8370 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 3.6250 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 2.1050 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 0.8340 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 3.0480 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 2.3940 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 5.9810 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 4.6860 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 6.0300 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 6.5320 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 7.2760 -5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 4.9900 -5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 4.2500 -5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 2.0800 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 3.0420 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 4.1720 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 2.6840 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 4.5810 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -2.5470 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 4.1160 -1.7340 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7010 4.4800 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 48 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END