PUBCHEM-ZINC05543114 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1820 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 2.2320 -1.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 3.2540 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 4.1360 -1.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 3.2520 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 2.1940 -3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 1.2580 -2.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 1.3110 -1.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 2.4140 -5.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 3.5600 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 4.0500 -4.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 1.5700 -5.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3270 1.1580 -5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 0.4250 -6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 0.3260 -8.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3060 -0.2880 -8.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7520 1.8120 -8.2990 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8780 2.3410 -8.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 2.3440 -7.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 1.9160 -9.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1380 3.2900 -9.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -0.1720 -9.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -0.6940 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7040 -1.9120 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -0.0700 -0.0440 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 3.1960 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 1.6880 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 3.9970 -6.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -0.5050 -6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 0.6860 -6.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8110 1.4940 -8.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6610 1.3660 -10.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 3.4320 -10.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -1.0620 -8.8110 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 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 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END