PUBCHEM-ZINC05997312 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.1400 1.2280 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -0.1880 -0.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.6590 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 0.0080 0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -2.1630 0.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6550 -2.4840 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -2.5070 -0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1370 -1.9870 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -4.0150 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -4.4110 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -3.1130 2.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4360 -3.0730 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -1.8580 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 -1.1760 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 0.1190 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -2.8040 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -2.8500 1.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3220 -3.8990 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.2460 1.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -3.0010 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -4.1330 2.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 -2.2720 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -2.8950 3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -2.2440 3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -0.9700 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -0.3460 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -0.9940 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 1.4900 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 1.7450 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 1.5360 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 -4.2350 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -4.5800 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -4.8350 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -5.1780 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 -2.8300 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -1.2500 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -1.7880 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 0.7830 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 0.5480 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -1.8200 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -3.5210 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -3.8900 3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.7300 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 -0.4630 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 0.6470 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -0.4840 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -2.0600 1.2930 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9430 -1.1160 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 9 1 0 0 0 0 7 47 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 47 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 47 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END