PUBCHEM-ZINC03636678 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 0.2760 1.6270 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.3500 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.2570 -0.5500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6810 -0.8200 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 0.9870 -0.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7930 1.4580 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 1.9050 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 0.6950 -0.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 0.2610 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -1.1870 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -2.4360 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -3.3740 -2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -4.6210 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -5.5590 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -6.8060 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -7.7440 -4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -8.9910 -4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -9.9290 -5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -11.1740 -5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -12.1760 -6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -11.8790 -7.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 2.4590 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 1.4990 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -0.3360 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 0.6080 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 2.9570 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.6770 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.6460 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -1.4930 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.9660 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -2.1460 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -2.8430 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -3.6710 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -5.1520 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.3240 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -5.0280 -4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -5.8560 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -7.3370 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -6.5090 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -7.2130 -5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -8.0410 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -9.5220 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -8.6940 -4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -9.3970 -6.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -10.2240 -5.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -11.7040 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 -10.8750 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -13.1980 -6.0870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 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 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 M CHG 1 48 -1 M END