PUBCHEM-ZINC05162521 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.0760 1.6480 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.2730 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.5090 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 0.1010 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 1.4750 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 2.2480 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -0.8990 0.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -0.0950 0.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -2.1690 0.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -1.1770 -1.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -0.0310 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -0.5120 -3.7430 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1490 -1.0650 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 0.7060 -4.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 0.3080 -5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 1.5350 -6.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 1.1150 -7.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 2.3200 -8.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9240 1.9670 -9.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0690 0.7380 -10.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -1.4490 -4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6970 -2.8080 -4.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -3.6570 -5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -3.1190 -6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -1.8170 -5.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 -1.0160 -5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 2.2550 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.1890 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -1.5800 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 1.9510 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 3.3180 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -1.9770 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 0.4700 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 0.6850 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 1.3190 -4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 1.3470 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 -0.2670 -5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -0.3400 -6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 2.1420 -6.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6870 2.1600 -5.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 0.5220 -7.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 0.4650 -8.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3370 2.9270 -8.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8930 2.9500 -8.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -3.2130 -4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -4.7110 -5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -3.7390 -6.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 0.0250 -5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 2.9720 -10.6610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 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 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 49 -1 M END