PUBCHEM-ZINC04684266 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.1590 0.1030 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.7810 -0.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1780 -1.4040 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 0.0810 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.3750 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 0.0540 2.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -1.3260 1.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -1.6360 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -2.4660 -0.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -1.9500 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -1.7430 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -2.3570 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -3.1820 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -3.3900 3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -2.7790 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -4.2690 4.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0800 -3.9850 5.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -5.2760 4.3090 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.2000 -3.8040 2.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 -3.6880 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 -3.8750 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9300 -3.7530 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9480 -4.8280 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7430 -4.6410 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4530 -4.7630 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 0.7550 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.5260 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 0.7090 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.1150 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 1.1400 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -1.1020 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -2.1950 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -2.9440 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 -4.3120 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4800 -2.7020 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5940 -4.8610 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6270 -3.1090 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7880 -3.8870 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9760 -2.7670 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9020 -5.8140 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8670 -4.7420 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7560 -5.4070 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7890 -3.6550 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5940 -4.6290 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 -5.7490 1.4520 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 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 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 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END