PUBCHEM-ZINC05352960 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 -0.4470 1.4100 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.1090 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 0.3610 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -0.8700 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1840 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -0.8790 -2.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7960 -1.2640 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -0.3450 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -1.3850 -3.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -0.8650 -3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6010 -0.7090 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -0.2130 -3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 0.1140 -4.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9240 -0.0430 -5.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 -0.5660 -5.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -0.8420 -6.1100 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -0.7070 -7.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 0.4980 -7.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 0.2950 -6.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8180 -0.5200 -7.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9920 1.4900 -6.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -1.9840 -1.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -2.5890 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 2.1450 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 1.2330 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 1.8700 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 0.7290 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.5570 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 1.1140 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -1.0850 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -1.8230 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -0.4580 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 0.7020 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 0.9000 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 0.5640 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -0.1250 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 -0.9790 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6440 -0.0840 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9380 0.5010 -4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -1.6300 -7.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -0.6060 -8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 0.6620 -8.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 1.4160 -7.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2680 1.6070 -7.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.5600 -1.3440 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4310 -1.4140 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -0.9210 -2.1480 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 4 1 0 0 0 0 2 45 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END