PUBCHEM-ZINC05512717 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 0 0 0 0 0 0999 V2000 1.0050 1.1660 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -0.3270 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.6930 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -2.1960 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.5500 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -4.5020 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -5.9300 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -6.4050 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -7.8320 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -8.3080 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -4.5390 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -4.6900 -3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -4.7150 -1.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 -4.7900 -4.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 -4.9000 -3.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 -5.0170 -4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3830 -5.1340 -4.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 -5.2890 -5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 -5.3460 -4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1710 -5.2200 -3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 -5.0910 -2.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8610 -5.2000 -1.7770 N 0 3 0 0 0 0 0 0 0 0 0 0 12.0900 -5.3350 -1.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1910 -5.0500 -0.7480 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0380 1.4960 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 1.7390 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 1.4050 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.8710 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.6290 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -0.1430 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -0.3830 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -2.7430 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -2.4990 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.0510 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -2.2710 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -4.4080 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -3.8260 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -6.6140 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -5.9750 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -5.7300 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -6.3590 -3.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -8.5120 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -7.8820 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -9.3300 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -7.6670 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -8.3010 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -3.8260 -4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -5.5230 -4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -4.7850 -5.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -5.0330 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4230 -5.3540 -6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6540 -5.4620 -4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -4.0480 -2.6410 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7380 -4.4870 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 53 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 53 1 M END