PUBCHEM-ZINC05502832 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.2330 0.3850 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.6840 -1.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -0.8890 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -0.2170 -1.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -2.0740 -0.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5120 -2.8700 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -1.6120 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.7390 1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -3.2910 2.2440 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6710 -2.9770 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -4.2930 3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -4.8970 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -4.4100 3.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -5.0990 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -3.4650 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -3.4360 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -2.5470 -0.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -3.3120 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -3.7150 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 -3.0290 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5620 -3.3820 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -4.4250 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -5.1110 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -4.7590 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -3.8060 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -4.9510 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -5.4080 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -4.7220 -4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -3.5780 -4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -3.1150 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 0.4460 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 0.1870 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 1.3360 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -1.1540 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -0.8500 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -2.2050 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 -2.8420 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2030 -4.7000 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -5.9220 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -5.3210 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -5.4850 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -6.2980 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -5.0810 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -3.0490 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -2.2210 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 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 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 M CHG 1 9 1 M END