PUBCHEM-ZINC05854259 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.2390 1.6140 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.1930 -0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.4490 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -1.8400 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -2.6250 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -2.0250 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -0.6260 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 0.1550 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -2.8290 0.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -4.2110 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -4.6970 0.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 -3.5950 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -2.4250 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 -1.1760 0.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8980 -1.1770 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6900 -2.2320 1.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1690 -3.4830 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9360 -4.5940 1.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3670 -4.5690 1.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.6460 -3.6950 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2120 -4.7180 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3450 -3.4430 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5790 -3.2440 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6980 -2.0610 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5840 -1.0690 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3500 -1.2560 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2310 -2.4370 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7070 -5.8580 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9180 -6.8350 2.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 1.9690 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 2.0260 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.9740 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -2.3240 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -3.7000 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -0.0920 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 1.2340 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -4.8340 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3730 -0.2040 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5160 -5.5250 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7970 -5.5070 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2300 -5.0550 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 -4.0060 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0960 -1.9150 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6750 -0.1480 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0380 -0.4820 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8280 -2.5710 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7300 -5.7790 3.3880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 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 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 M CHG 1 47 -1 M END