PUBCHEM-ZINC05592528 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.0860 1.8630 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.3380 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -0.4320 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -0.0050 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.0570 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.9700 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.8200 2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -4.2110 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -4.8030 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -3.9870 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.5900 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -6.1690 0.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -6.8300 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -8.3150 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -9.0160 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -10.3910 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -11.1040 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -10.3860 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -9.0120 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -12.5530 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -13.2170 0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -14.5650 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -14.9000 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -13.5280 1.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -16.2320 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -17.1820 1.5470 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7320 -15.4420 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 2.2680 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 2.2720 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 2.2340 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 0.0250 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 0.0590 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.0680 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -0.5110 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -0.2360 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -0.3250 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.5650 3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.0150 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -2.4100 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -4.8380 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -4.3950 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.0090 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -6.5710 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -6.5530 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -8.4960 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -10.8820 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -10.8990 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -8.4960 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -15.8910 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -16.2350 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -14.8660 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -16.3640 2.5210 O 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 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 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 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 2 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M CHG 1 26 -1 M END