PUBCHEM-ZINC06922958 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.5290 1.2620 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -0.1610 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.9100 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.1730 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -2.2150 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -0.9550 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.6970 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -1.7200 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -2.9910 -2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -3.2390 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -3.9140 -3.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -5.1950 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -1.4820 -4.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -0.9180 -5.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 0.5320 -3.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 0.4980 -3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -0.4230 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 0.6050 2.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -1.2050 3.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.9940 4.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2630 0.0800 5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -1.7900 5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -1.3060 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -0.1680 5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.2850 4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.3910 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -1.5220 3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -1.9790 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -1.5660 5.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -2.4700 5.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 1.4010 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 1.7060 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 1.7470 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -3.0120 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -4.2050 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -5.7960 -4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -5.7080 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -5.1230 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -0.7750 -6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -1.5890 -5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0620 -4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 1.5130 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 0.1880 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -0.1560 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -1.9890 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.7540 6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.8550 5.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 0.3740 6.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 1.1710 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 -0.0330 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 -2.0440 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -2.8540 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -1.0690 6.9130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 53 -1 M END