PUBCHEM-ZINC01197064 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 1.4680 -3.1210 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -2.1620 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.7520 -1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.6160 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -3.6090 -1.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -1.9190 -0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 -2.2980 -0.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1200 -3.3840 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -1.7810 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -2.6100 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 -2.1360 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -0.8330 3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -0.0050 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -0.4800 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -0.3250 4.7370 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2190 -1.0550 5.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 0.8220 5.0950 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7250 -1.7020 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -0.5360 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 0.0270 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -0.5740 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6150 -0.0210 -4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 -0.6590 -5.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1770 -1.8240 -4.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -2.3350 -3.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -1.7600 -2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 -2.3180 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 -3.4580 -1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -2.7920 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -4.1260 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -3.1270 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -2.1550 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.0690 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -0.4230 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -0.7580 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -1.1670 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -3.6270 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -2.7830 3.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 1.0130 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 0.1660 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -0.0720 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 0.9310 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2480 0.8820 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2420 -0.2620 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0530 -2.3180 -4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 -3.3080 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 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 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 46 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END