PUBCHEM-ZINC03652980 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.9140 -0.8600 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.2470 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 1.3080 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -0.3410 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -0.2420 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -0.7800 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -1.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -1.5190 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -0.9740 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -1.9660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 -1.7230 1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7870 -0.8850 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5750 -1.4000 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3440 -0.4860 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6240 -0.1900 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1340 -0.8070 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3640 -1.7200 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 -2.0130 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5040 -0.4900 -0.5920 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.1830 0.3140 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9540 -1.0340 -1.5850 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.2220 -3.2140 2.2510 P 0 0 0 0 0 0 0 0 0 0 0 0 -6.8660 -4.3210 1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -3.6350 2.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -4.8230 3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 -2.9040 3.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -3.9020 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.4340 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -1.6160 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -1.3180 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.7050 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 1.7340 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 0.8500 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 2.0970 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 0.2570 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -0.7020 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.0170 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.0460 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -2.5060 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9460 -0.0040 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2250 0.5240 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7630 -2.2020 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4800 -2.7240 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7580 -5.6930 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -4.8910 3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -4.7920 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9380 -3.4540 5.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 -4.6980 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 -4.3150 4.9630 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 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END