PUBCHEM-ZINC00642982 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.5960 0.6980 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -0.7630 -0.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -1.4180 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -1.1420 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -0.8160 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -1.1900 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -1.8870 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 -2.2390 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -1.8580 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -2.2050 -2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -2.8960 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -3.2650 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -2.9570 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -3.4360 -2.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 -4.0970 -3.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -4.0400 -0.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 -2.0470 -2.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -1.1820 -3.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1400 -1.7630 -4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7390 -0.6070 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7290 -1.7240 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3390 -2.8680 -3.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0470 -1.4530 -3.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -0.0550 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 0.0180 -2.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 0.9660 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.1540 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 1.0570 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -1.0820 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -2.4990 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -1.1600 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -0.2650 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -0.9240 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -2.1690 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -1.9250 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -3.1620 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -3.8120 -4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 -1.8060 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9520 -0.1010 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8200 0.1050 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3590 -0.5380 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6850 -2.1720 -3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 0.8680 -4.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 1.5720 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 43 44 1 0 0 0 0 M END