PUBCHEM-ZINC04223571 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0010 1.3140 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.1960 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -0.5730 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -2.2540 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -2.6870 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -2.0220 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -0.9110 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -0.3300 -2.1900 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 -1.5180 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -2.3720 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -3.4490 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2210 -3.6790 -0.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -4.1350 0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 -5.1840 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1210 -1.5940 -2.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7410 -0.7730 -3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1980 0.1820 -3.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 -1.1370 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8690 -0.4590 -4.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1370 -1.0100 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1890 -0.5470 -5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4210 -1.2080 -5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6170 -2.3180 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5900 -2.7970 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3560 -2.1260 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 -2.4680 -2.6300 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -0.2700 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 1.6850 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 1.8530 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.5780 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -0.6580 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -0.2570 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -1.6540 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.0860 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -2.5460 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -2.6950 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -3.7760 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -2.4310 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -4.7760 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 -5.9350 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 -5.6620 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -2.3610 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0370 0.3190 -5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2320 -0.8500 -5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5820 -2.8220 -4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7440 -3.6630 -2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -0.5560 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 0.8180 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.7350 0.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9020 -0.3510 0.8930 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 31 1 0 0 0 0 2 49 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 35 1 0 0 0 0 4 36 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 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 49 50 1 0 0 0 0 M CHG 1 49 1 M END