PUBCHEM-ZINC03801072 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 62 0 0 1 0 0 0 0 0999 V2000 -0.6280 1.0140 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -0.3530 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -0.9260 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.2360 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -2.4630 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -1.2650 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -1.1390 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -2.2560 -3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -3.4580 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -3.5740 -1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -3.1580 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -3.4270 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -4.4210 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -4.8840 4.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -4.7090 3.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -4.0060 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -4.0550 1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -2.9150 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -3.0120 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -3.5990 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -3.5010 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -2.8350 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -2.2510 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -2.3550 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -1.8880 3.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -2.2130 3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -1.8290 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -0.6800 5.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8140 0.2410 4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -0.9990 5.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 -1.1310 4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -0.4770 6.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 1.5280 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 1.0040 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 1.5120 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -0.3610 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -0.2060 -3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -2.1820 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -4.3160 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -4.5200 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -5.3670 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -4.1210 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 -3.9490 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4380 -2.7680 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4160 -1.7330 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -2.7120 5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -1.5320 4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 -1.9380 6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 -0.2230 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 -0.1390 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -1.6210 4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -1.3280 7.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.2970 6.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 0.7160 7.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6670 0.9160 8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 0.5890 7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 1.5620 7.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 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 40 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 26 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 32 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 54 1 M END