PUBCHEM-ZINC00627565 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.7000 1.3980 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 0.0140 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -0.6300 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 0.0870 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 1.5060 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 2.1390 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 2.2910 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 1.7030 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 0.3170 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -0.5080 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -1.9270 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -2.6700 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -2.2370 -1.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -4.1560 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -4.6950 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -6.0760 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -6.9240 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -6.3980 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -5.0160 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1550 -4.4500 -0.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 -5.0800 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 -6.2730 -0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -4.0740 -0.6820 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3170 -3.3220 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6160 -3.3620 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7800 -2.3840 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1020 -3.0710 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0650 -3.7570 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8950 -4.7460 -1.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0690 -5.5860 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9690 -5.3020 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0240 -4.9640 -3.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.9030 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.5720 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -1.7140 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 3.2250 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 3.3770 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 2.3190 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 -0.0890 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -2.4430 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -4.0650 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -6.4920 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -8.0020 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 -7.0980 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 -3.4360 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 -2.8210 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7080 -4.1070 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6180 -1.5590 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8200 -1.9430 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9140 -2.3350 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3240 -3.8120 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9910 -2.9940 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0210 -4.2710 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9800 -6.0220 -2.7100 O 0 5 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 33 1 0 0 0 0 2 3 2 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 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 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 29 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 M CHG 1 54 -1 M END