PUBCHEM-ZINC03333089 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.5250 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0050 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5250 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.7890 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.2660 3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -1.4720 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -1.2120 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -0.7310 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 -1.5210 2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -1.9600 3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -1.9260 4.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -2.3090 5.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 -2.3470 4.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4510 -2.2690 3.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6700 -2.6430 4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 -2.5900 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8300 -2.1550 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5950 -1.7760 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 -1.8230 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -1.4440 1.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1000 -2.0920 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 -1.6850 0.2210 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9840 1.9540 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8810 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.9130 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -0.3980 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.3570 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.6220 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -1.4660 4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -0.5240 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -3.1280 5.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -2.6390 6.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -1.4420 6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 -2.9850 5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7900 -2.8910 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 -1.4340 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1730 -2.4520 1.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 20 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 37 2 0 0 0 0 M CHG 1 22 -1 M END