PUBCHEM-ZINC06024602 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -1.5680 0.7200 2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6110 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -0.9400 0.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -2.1010 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.9030 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -4.0990 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -4.4740 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -3.6680 -1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -2.4850 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -4.0650 -2.9790 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2260 -5.1480 -3.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2470 -3.3100 -3.3450 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5930 -4.9550 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -6.3020 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -7.1630 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -7.8460 0.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -6.8700 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -8.2070 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -8.9380 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -8.3200 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -9.3950 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -9.1680 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -7.8720 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -6.8010 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -7.0070 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -6.1700 0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 -7.6440 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -10.3340 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 0.9700 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 1.5040 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 0.6340 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -0.5250 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -1.3950 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -2.6080 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -5.3950 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -4.5200 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -10.4060 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -5.7970 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1910 -7.6130 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0710 -6.6980 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 -8.4570 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -10.6390 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 -10.0400 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -11.1660 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -1.6970 -1.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -1.0360 -2.1980 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 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 3 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END