PUBCHEM-ZINC03736350 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 -1.6640 2.2480 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 0.8140 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -0.0390 -0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -1.3880 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -2.0070 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -3.4020 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -4.1550 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.5660 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -2.1620 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -4.6190 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -5.8110 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -5.5200 -0.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -6.1920 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -7.1810 0.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5310 -7.4840 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 -5.9020 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -4.5760 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -8.2030 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -7.8310 -2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -8.7190 -3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -10.0040 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -10.4230 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -9.5310 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -10.0400 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -11.3500 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -12.1960 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -11.7340 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 2.9460 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 2.3890 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 2.4970 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.5870 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 0.6970 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.4310 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -3.8750 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -1.6740 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -6.0210 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9540 -5.9820 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 -3.7490 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -4.4020 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -6.8310 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -8.4110 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -10.6830 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -9.4380 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -11.7060 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -13.2140 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -12.4160 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -7.0760 0.2200 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7230 -7.0120 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -7.9550 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 47 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 47 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 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 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 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 47 1 M END