PUBCHEM-ZINC03735586 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.1300 1.7910 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 0.3040 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -0.2320 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -1.6210 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -2.4530 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.9530 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.5580 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -3.0720 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -4.2140 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -3.8320 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -4.4550 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -5.6240 -1.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1060 -5.9820 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -4.5080 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -3.1320 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -6.5790 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -6.1400 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -7.0380 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -8.3890 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -8.8500 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -7.9570 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -8.3210 -1.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -9.6820 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.1160 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 2.1360 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.0730 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 2.3100 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.4460 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -0.1540 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -4.6470 -3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -4.6530 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -2.3480 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.9580 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -5.0920 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -6.6860 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -9.0890 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -9.9160 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -10.3470 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -9.9680 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -9.7820 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -1.7570 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -3.2080 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -1.7530 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -5.6110 -3.2660 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8680 -5.5340 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -6.5330 -3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 44 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 44 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 M CHG 1 44 1 M END