PUBCHEM-ZINC05509049 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 0 0 0 0 0999 V2000 -0.0110 0.9980 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 0.8970 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.9770 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 3.4340 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 4.9530 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 5.6690 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 5.0600 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 5.8130 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 7.2070 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 7.9600 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 9.3330 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 9.9760 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 9.2650 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 7.8590 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 7.0840 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 7.7280 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 7.0440 3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 5.6540 3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 4.8770 3.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 5.5410 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 9.1340 2.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 9.9540 1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 11.1740 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 11.3290 0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 11.4600 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 10.1920 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0950 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.4060 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 1.3540 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 1.3360 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.1880 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 1.1280 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 3.2940 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 3.3770 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 2.9920 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 3.0710 3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 3.9800 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 5.2930 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 7.4900 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 7.6240 3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 4.7750 5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 6.1880 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 6.1000 5.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 12.0250 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 12.0200 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.4650 1.2990 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5400 1.0640 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 46 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 46 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 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 18 2 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END