PUBCHEM-ZINC06158500 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 3.0620 1.7340 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 0.8600 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -0.1920 1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -1.6100 1.9350 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1590 -1.6750 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.6630 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -3.8760 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -4.3280 4.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -4.4460 2.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -5.6110 3.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4020 -5.6510 4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -5.5130 2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -4.3530 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -4.4330 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -3.3460 5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 -2.1640 4.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -2.0780 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 -3.1660 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 -1.1820 5.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 0.0490 5.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 0.9790 6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7250 0.9140 6.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2520 1.7600 7.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 2.6720 8.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0690 2.7360 7.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 1.8910 6.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -6.8830 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -6.9070 0.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -6.0340 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -2.0350 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -3.1480 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 1.7020 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 2.4740 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.9020 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.0700 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.0080 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -2.2140 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -3.0320 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -4.0000 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 -6.4390 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -5.4270 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -5.3370 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8270 -3.4190 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8390 -1.1830 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 -3.0740 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5320 -0.1090 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 0.5020 4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 0.1990 5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3070 1.7030 7.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8350 3.3270 8.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4220 3.4410 8.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 1.9430 6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -7.7770 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -6.9460 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -1.2890 -0.4380 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 30 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 M CHG 1 55 -1 M END