PUBCHEM-ZINC06861368 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.6700 1.7900 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 0.3850 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -0.1700 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -1.8210 0.5390 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.6760 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.4900 -1.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.7170 -1.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -4.0100 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -4.4550 -0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -4.8800 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -6.3140 -2.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -7.0370 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -7.9320 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -10.0180 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -11.0650 -3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -10.4530 -3.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -9.5290 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -8.3950 -2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -7.0460 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -8.2620 -2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -6.3040 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -7.2590 -2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -7.2750 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -5.8270 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -5.4070 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 1.8360 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 2.3820 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 2.2460 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 0.3020 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -2.4400 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -4.7350 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -4.5420 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -7.6490 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -6.3170 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -7.3430 -4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -8.4820 -3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -10.4730 -4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -9.4760 -5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -11.7760 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -11.6340 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -9.1160 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -10.0650 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -7.8290 -3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -7.7320 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -5.7280 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -8.2650 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -6.8440 -3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -7.9280 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 -7.6170 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -5.7070 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -5.2190 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -4.3470 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -5.5390 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -8.9810 -3.2160 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3840 -9.4780 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 54 1 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 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 54 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END