PUBCHEM-ZINC06470886 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.7570 1.4730 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 0.1390 -0.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9470 0.2630 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -1.0070 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -0.7870 -2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.1640 1.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.7280 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -1.2230 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -2.6090 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -3.5020 1.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -2.9540 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -1.7460 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -0.6590 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -0.1910 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 0.9870 1.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.9150 3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 0.2620 4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.0530 5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 0.3360 6.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -0.0680 7.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.5500 7.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.4750 6.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -0.0300 8.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 0.0460 7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 1.0840 6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.8920 5.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 1.2500 4.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 1.4420 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 1.7500 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 2.2700 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -1.3960 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -3.6930 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -3.4180 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -1.3530 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -2.0500 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 0.1950 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -1.0160 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -1.8620 3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -0.9980 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 1.1850 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 0.4280 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 0.8530 9.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -0.9180 9.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 0.2730 8.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.9410 7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 2.0960 6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 1.0140 6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -2.0340 -1.2230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 48 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 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 2 0 0 0 0 M CHG 1 48 -1 M END