PUBCHEM-ZINC06223580 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.6220 1.8070 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 0.2970 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -0.2810 1.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -1.6250 1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.3720 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -3.7380 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -4.3610 1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -3.6190 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -2.2510 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -4.3010 3.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5320 -3.5870 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -4.8210 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -4.1820 3.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -4.6560 2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 -5.7770 1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -6.4170 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -5.9410 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 -6.2590 1.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 -5.5130 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0410 -7.5100 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -6.3510 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -7.1170 6.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -6.1900 6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -4.9420 5.3640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0370 -4.1640 5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -4.4280 4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -4.3920 3.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 2.2490 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 2.2480 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 2.0000 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -0.1450 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 0.1040 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -1.8860 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -4.3200 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -5.4290 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -1.6710 3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -3.3100 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 -4.1550 2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -7.2890 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -6.4410 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -5.8540 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9430 -5.6820 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0910 -4.4500 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 -7.8710 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 -7.3340 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6480 -8.2560 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -5.7930 5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -7.0410 4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -8.0600 5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -7.2950 6.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -6.6790 5.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -5.9140 7.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -5.4200 4.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -4.0100 5.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -3.6890 5.0370 H 0 0 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 53 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 54 55 1 0 0 0 0 M END