PUBCHEM-ZINC06308581 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.5570 1.6030 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.0660 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -0.3640 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -1.7920 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -2.5710 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -3.8410 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -3.8210 2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -2.5170 2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -5.0960 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -5.8220 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -7.0140 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -7.3240 -0.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -7.7680 -2.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4030 -9.2610 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -9.7580 -2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -9.2210 -4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -7.6830 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -7.1770 -3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.2300 -4.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -9.8300 -5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -9.6320 -5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -9.9910 -1.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -11.4470 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -12.1050 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -12.2340 -1.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -2.0280 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -2.7170 -1.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.5180 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.3990 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 2.0530 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.9510 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 1.9900 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -0.1770 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 0.2170 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -5.7640 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -4.8520 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -5.1430 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -6.1800 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -10.8490 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -9.4060 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -7.3040 -5.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -7.2390 -3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -10.9240 -5.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -9.4810 -6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -9.5640 -4.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 -9.2270 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -9.2630 -6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -10.7220 -5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -7.6390 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -11.6910 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -11.8750 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -0.0360 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -0.3110 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 0.0240 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -1.4880 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.0770 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -12.4930 0.4250 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 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 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 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 57 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M CHG 1 57 -1 M END