PUBCHEM-ZINC00334927 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.6870 1.7940 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 0.3240 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.3830 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -1.7620 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -2.4700 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -1.7550 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -0.3770 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -3.8440 -0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -4.7490 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -4.3320 -2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -5.2820 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -6.6140 -3.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -7.0140 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -6.1340 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -6.8590 0.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -5.7050 1.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -7.4020 0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -7.9400 0.4970 N 0 5 0 0 0 0 0 0 0 0 0 0 2.2140 -7.4290 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 1.9620 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 2.2810 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 2.2760 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 0.1300 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -2.2830 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.2750 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 0.1420 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -4.3250 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -3.2850 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -4.9820 -4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -8.0890 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 18 -1 M END