PUBCHEM-ZINC06159959 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.4880 1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.2740 2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 0.2400 3.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -0.7070 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -2.2030 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -2.7000 3.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -4.1530 3.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6160 -4.6420 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -4.5620 5.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -4.2550 4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -3.0750 5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -3.2180 4.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -4.4410 4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.1230 4.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -6.0540 4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -4.5720 3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -3.7410 3.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -0.2970 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 0.2000 1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.5100 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.4990 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -2.8550 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -0.2120 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -4.0060 5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -5.6300 5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.1730 5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -4.8430 4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -0.1220 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -1.5890 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.1390 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -5.8670 4.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -6.0870 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 36 37 1 0 0 0 0 M END