PUBCHEM-ZINC02548392 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0680 1.5070 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.1140 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -0.6380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 0.0450 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 1.4350 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 2.1900 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 3.6980 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 4.2440 -0.0240 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5180 -0.5870 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -1.9220 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -2.6820 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.0450 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.8330 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -4.2740 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -4.9300 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -6.4480 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -7.2070 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -6.5120 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 2.0620 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -0.3720 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 1.9580 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -2.4410 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -2.4280 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -4.5840 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -4.6160 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -4.6170 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -4.5850 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -6.7520 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -6.7840 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 4.3050 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -8.4640 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 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 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 M CHG 1 8 -1 M CHG 1 31 -1 M END