PUBCHEM-ZINC00570112 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 2.2170 1.8740 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 0.5040 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -0.2750 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 0.1450 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.7570 -3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -2.0870 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -2.5140 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -1.6070 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -3.9140 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.1110 -0.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -4.8860 -2.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -6.2980 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -7.1680 -1.3990 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -6.8230 -3.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -8.1170 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -8.4030 -5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 -9.6410 -5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -10.6270 -4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -10.3290 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -9.0870 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -11.9660 -5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -12.1540 -6.2590 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1310 1.9820 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 2.3840 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 2.3520 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 1.1700 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.4160 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -2.7560 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -1.9350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -4.5380 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -6.1890 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -7.6740 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -9.8390 -6.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -11.0700 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -8.9090 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -12.8000 -4.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 2 0 0 0 0 M CHG 1 22 -1 M END