PUBCHEM-ZINC00877578 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.6760 1.7810 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 0.3640 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -0.2910 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 0.2980 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -0.4960 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 -1.8810 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -2.4910 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -1.6790 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -3.9990 0.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8840 -4.2180 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -4.6680 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -6.1360 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -6.5630 -0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -6.8670 -2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -8.2630 -2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -8.7800 -3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -10.1510 -3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -11.0070 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -10.5150 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -9.1410 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -12.7820 -3.2240 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -13.3670 -1.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -12.9910 -3.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -13.0180 -4.1990 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.4070 -12.7960 -3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -4.5300 0.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -4.5840 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -4.1210 3.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -5.2250 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 -4.7060 4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8210 -5.2890 4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4190 -6.3950 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 -6.9250 2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -6.3450 2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 2.1480 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 2.0870 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 2.2300 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 1.3690 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -0.0320 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 -2.4760 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -2.1270 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -4.5670 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -4.1880 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -6.3580 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -8.1260 -4.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -10.5460 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -11.1880 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -8.7900 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -4.8480 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -3.8470 4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2330 -4.8830 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2970 -6.8500 4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -7.7990 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3310 -6.7970 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 24 -1 M END