PUBCHEM-ZINC03874846 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.5510 1.6640 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 0.2050 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5960 -0.1560 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6370 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -2.1280 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -2.8670 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -4.2400 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -4.8880 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -4.1630 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.7890 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 0.1750 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.5280 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -0.5600 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -1.2910 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -2.0000 2.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -1.9020 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -1.2180 1.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -1.1270 1.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -0.3480 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 0.0170 0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -1.6720 2.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0530 -2.4560 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 -0.5990 3.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3790 0.2860 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6630 -1.2670 3.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.4850 -0.5600 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7330 -1.9550 1.9920 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.0440 -1.2400 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3850 -2.3410 1.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6170 -3.1930 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6460 -3.7050 0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7090 -3.7300 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -2.2070 4.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 -1.8000 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 -0.4840 4.5640 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6420 1.7490 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 2.0910 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 2.2780 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.3990 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -0.3710 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.3710 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -4.7990 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -5.9570 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -4.6670 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -2.2380 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 0.6690 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -2.4430 3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4790 -0.0810 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2290 -3.9920 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6440 -2.9610 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 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 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 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 20 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 35 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 33 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 35 -1 M END