PUBCHEM-ZINC01997800 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -3.6270 -2.7000 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -3.4240 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -2.9380 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -3.8280 2.7930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -3.0720 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -1.9420 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -1.3040 4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -1.7850 3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -2.9110 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -3.5540 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -4.7300 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.6920 0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -5.8290 2.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -7.0680 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -8.2280 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -9.9710 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -10.6210 4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -7.6070 3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -7.0840 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -2.8750 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -3.0590 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -1.6210 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -3.2530 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -4.5020 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -3.1140 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -1.8640 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -1.5420 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -0.4260 4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -1.2780 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -3.2810 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -7.1870 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -7.0480 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -9.0970 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -7.9830 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -9.7400 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -10.6510 3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -11.6170 4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -10.0460 5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -10.7360 3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -8.0300 4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -6.8120 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -7.8640 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -6.6590 5.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -6.2890 5.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -8.6870 3.2790 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2410 -8.9530 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 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 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 45 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 45 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END