PUBCHEM-ZINC05138417 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 1.3470 -0.7530 -5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.8330 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -1.8900 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -1.9620 -1.3390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9060 -0.9450 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -2.9010 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -2.2190 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -1.0140 0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -3.0790 0.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -2.5030 1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -2.4910 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -3.3530 -2.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -1.9920 -0.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -1.0920 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -1.4480 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -1.7780 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -2.3760 -0.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8560 -3.4700 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -1.7820 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -0.7420 -2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 -2.4910 -1.8260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -3.3260 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6790 -2.1320 -2.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6440 -1.0450 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -2.8590 -4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3540 -2.4760 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -2.5720 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 -2.5550 -2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1210 -3.6090 -1.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -0.4870 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -1.7110 -5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 0.0080 -5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 0.1490 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -1.0630 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.8680 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -1.6450 -2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -3.2900 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -3.7720 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -4.0790 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -1.5580 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -1.2200 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -0.0660 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -2.3400 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -0.6420 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -2.4760 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -0.8610 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 -3.9430 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 -1.3920 -5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -2.9410 -6.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3680 -2.8180 -5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -2.9730 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -3.0450 -5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -1.4960 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 -1.7910 -2.7400 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 M CHG 1 54 -1 M END