PUBCHEM-ZINC05592400 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.1360 1.7240 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 0.2090 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.4710 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -1.9930 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -2.5380 2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -3.9040 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -4.7990 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -6.1760 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -6.6960 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -5.7870 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -4.4010 3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -3.4570 4.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -3.9180 5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -8.1630 2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -9.0180 2.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -10.3310 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -10.4410 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -8.9040 4.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -11.6860 4.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -12.7780 3.7040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9920 -11.4100 1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0800 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 2.1890 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 2.0620 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.1110 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -0.0940 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -0.1460 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -0.1640 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -2.3220 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.3040 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -4.4660 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -6.8510 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -6.1660 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -4.4820 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -3.0400 6.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -4.5070 6.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -12.0330 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -12.0400 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -10.9860 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -11.6060 5.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 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 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 2 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 20 -1 M END