PUBCHEM-ZINC05751319 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.2070 1.2250 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.2820 -0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3870 -0.5990 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -0.6710 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -2.1140 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -2.4160 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -2.2430 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -2.5120 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -2.9520 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 -3.1180 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -2.8500 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -3.1780 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -3.6540 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -1.0760 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -1.4970 2.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7880 -2.5480 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -1.2910 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -0.0260 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 0.1420 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3010 -0.9540 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -2.2210 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -2.3810 1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -3.6600 1.4350 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 -4.8270 1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -3.2090 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6580 -0.7930 1.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -0.7410 3.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 1.5360 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 1.7700 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 1.5500 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -0.5120 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 0.0050 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -2.2870 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.8320 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -1.9010 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -2.3780 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5570 -3.4540 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -2.9860 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 -2.9210 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0220 -3.7950 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 -4.6240 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -0.0800 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -1.7920 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 0.8410 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 1.1330 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 -3.3710 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0510 -2.3370 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9600 -4.0520 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 -3.0020 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8830 0.1210 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -0.8100 3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.9930 0.9690 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7970 -0.5320 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -1.9460 1.1330 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 52 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END