PUBCHEM-ZINC05854900 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.3300 4.1460 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 3.0540 -2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 1.9980 -2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 3.2560 -2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 2.2580 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 2.5110 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 2.3560 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 2.7000 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3340 3.0610 -2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 2.9470 -3.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 3.1410 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 3.4970 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6040 3.5640 -2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 1.8970 0.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3340 1.7920 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 0.5620 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 0.7410 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 2.1910 2.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 2.8670 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 4.0740 1.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7350 2.8220 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 3.0050 4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 4.1690 4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 4.3370 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 3.3410 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 2.1780 6.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 2.0120 5.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.0460 -1.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 4.7840 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 3.7010 -3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 4.7430 -4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 4.1950 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1000 2.6880 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 0.4470 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -0.2830 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 0.2730 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 0.3120 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 3.7940 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 2.1890 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 4.9470 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 5.2460 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 3.4720 7.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 1.4000 7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 1.1040 5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 0.4110 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 3.8230 -4.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 4.1040 -5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 46 47 1 0 0 0 0 M END