PUBCHEM-ZINC05599195 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 0.2840 1.5150 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0120 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -0.4370 -0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0620 0.0820 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -0.5580 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -2.0730 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -1.9840 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8880 -2.3490 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -2.5110 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -3.7190 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7350 -3.7850 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -4.7490 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0510 -4.4830 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -3.2700 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 -2.2980 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -2.5750 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 -1.8150 0.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -0.4660 1.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2790 0.0880 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -0.3460 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 0.9170 3.0450 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.6070 0.4030 0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -4.6420 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -4.1510 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 1.7070 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 1.9610 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 2.0340 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.4390 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -0.3790 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -0.1360 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 1.1720 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -0.1860 -3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -0.2590 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -2.3850 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -2.5240 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -5.6910 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8300 -5.2250 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3810 -3.0700 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 -1.3470 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -0.1720 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 1.1840 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -1.1260 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -0.7480 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 0.9930 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -5.6500 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -4.7190 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -4.4410 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -4.5690 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -2.6200 -1.2970 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0650 -2.4080 -1.3010 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 7 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 49 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 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 20 1 0 0 0 0 18 22 1 0 0 0 0 19 40 1 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 20 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 49 1 M END