PUBCHEM-ZINC06073935 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.6910 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -2.1400 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1390 -2.4470 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -2.6430 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -4.0710 -1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -4.6860 -0.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0440 -4.3690 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -4.2650 0.6440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3000 -4.6160 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -2.7370 0.7280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2500 -2.4280 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -2.2730 0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -1.1360 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -0.5490 1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -0.5940 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -4.8420 1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -6.0520 1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -6.6100 1.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -6.7140 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -6.1430 -0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -6.8370 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -8.2180 -2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -8.9010 -3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -8.2110 -4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -6.8360 -3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -6.1470 -2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -8.9460 -5.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3980 -10.1580 -5.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 -8.3400 -5.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -2.3000 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -2.2550 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 -1.2540 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 -0.5360 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 0.4020 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 -6.8530 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -7.6820 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 -6.0840 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -6.6250 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -8.7570 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -9.9750 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -6.3000 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -5.0740 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M END