PUBCHEM-ZINC05928781 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -2.6170 0.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.1620 1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 -0.0490 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -0.2890 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6220 -0.1780 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 0.1730 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 0.4140 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 0.2990 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 0.5380 3.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 0.2910 1.5240 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.3800 0.0790 0.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 0.6000 2.5690 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -2.4430 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -2.3320 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -3.5820 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 0.0060 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -0.5630 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -0.3660 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 0.6880 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 0.4610 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 0.7800 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END