PUBCHEM-ZINC06601123 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 0 0 0 0 0 0999 V2000 -1.5040 2.2640 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 0.8780 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -0.1180 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -1.4140 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -2.4320 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -3.7480 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -4.0520 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -3.0320 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -1.7170 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -5.3850 0.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -6.3660 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -6.0880 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -7.7950 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -8.0740 1.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -8.7770 -0.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -10.1790 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -11.0830 -1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -13.3760 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -14.8070 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -15.1830 -0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -14.2720 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -12.8620 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -16.3320 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -17.1130 -0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -16.6420 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -17.1240 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -17.4120 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -17.2230 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -16.7450 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -16.4600 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -16.5450 4.8960 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0340 -16.8020 5.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -16.1250 4.9000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4720 2.4320 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 3.0240 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 2.3230 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.7100 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 0.8190 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.1950 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -4.5400 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -3.2680 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.9240 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -5.6020 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -8.5540 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -10.3560 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -10.4020 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -10.9060 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -10.8600 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -13.0410 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -13.3520 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -15.4870 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -14.8540 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -14.6000 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -14.2680 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -12.8460 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -12.1550 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -17.2710 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 -17.7850 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -17.4490 4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -16.0910 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -12.4890 -0.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 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 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 61 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 61 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 22 61 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 29 2 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M END