PUBCHEM-ZINC06146554 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.3920 1.5100 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.0040 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -0.6730 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -0.0160 0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -2.0090 -0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -2.5260 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -2.6800 0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8100 -3.7590 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.3420 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -3.2910 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -4.6360 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -4.7750 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -6.0330 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -7.1550 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -7.0240 2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 -5.7710 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -2.2190 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -1.3320 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -0.8960 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 -1.3430 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 -0.9140 -3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 -1.3910 -4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 -2.2760 -5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 -2.6740 -4.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 -2.2450 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -2.6720 -2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9920 0.0470 -0.8320 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.6990 0.9190 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1380 -0.0500 -1.2350 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5700 1.9990 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 1.9090 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 1.6940 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.1800 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.3960 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -1.3270 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -3.0810 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -3.9000 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -6.1420 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -8.1380 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -7.9040 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -5.6700 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -0.9860 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7380 -0.2270 -3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6630 -1.0820 -5.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 -2.6460 -6.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.5330 -2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -4.4650 -2.4810 H 0 0 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 33 1 0 0 0 0 2 34 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 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END