PUBCHEM-ZINC06068228 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4910 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.0260 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.1720 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 1.6180 2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 0.8650 3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -0.3340 3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -0.7820 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -1.2940 5.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -2.1100 4.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -0.3920 6.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.4550 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -1.2540 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -1.7000 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -1.3460 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -0.5470 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -0.0970 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -0.0970 -2.8080 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 0.2130 -1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -1.0880 -3.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8420 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8260 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8160 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.1390 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -1.5810 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.1130 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -0.1520 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -1.6020 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 1.7610 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 2.5550 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 1.2140 4.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -1.7210 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -1.5300 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.3240 -3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -1.6950 -4.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 0.5310 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -2.2380 4.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 1.2030 -3.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 1.5410 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -2.8160 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 2 1 M END