PUBCHEM-ZINC00109723 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.1270 1.4620 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.0360 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.7760 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -2.1980 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -3.2780 1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -4.5070 1.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -4.7380 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -3.7730 -0.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.4980 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -1.0180 -1.4630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -3.0520 3.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.1320 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -4.0200 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -5.0880 6.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -6.2700 5.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -6.3850 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -5.3180 3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -7.6510 4.0350 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3860 -8.5910 4.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -7.7540 2.9080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8500 1.9350 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.7680 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 1.7660 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.3560 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -5.7540 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1440 3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -3.0970 5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -5.0010 7.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -7.1040 6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -5.4070 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END