PUBCHEM-ZINC05631634 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 0.3690 0.5290 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.3670 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 2.2660 -2.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 1.0800 -1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 1.7290 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 1.3640 -2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 2.7240 -3.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 3.4620 -4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 4.5430 -5.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 5.4660 -4.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 4.3850 -6.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 5.3130 -7.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5120 5.7190 -6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 6.4410 -7.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 7.4170 -6.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 8.5930 -7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 8.6710 -8.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 9.5920 -6.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 10.4160 -6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 9.5330 -5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 4.5710 -8.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 3.4620 -8.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -0.4100 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 0.2830 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 1.0900 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 0.3040 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 1.9460 -3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 2.9700 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 2.7740 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 3.9670 -3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 3.5670 -6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 7.0060 -8.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 6.0140 -8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 6.9200 -5.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 7.7990 -6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 5.1450 -9.1740 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 36 -1 M END