PUBCHEM-ZINC04228245 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.2840 1.4880 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.2750 0.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.5620 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -2.0280 -1.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7040 -2.3840 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -2.2460 -3.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1950 -1.6310 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -3.7410 -3.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1680 -3.8220 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -4.0390 -2.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3480 -4.8450 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -2.8470 -1.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -4.3880 -3.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -3.5440 -4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -4.1540 -4.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -5.4510 -4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -5.6140 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -6.7390 -2.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -7.7510 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -7.7420 -3.9590 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -6.5790 -4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -6.5520 -5.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.4200 -3.0600 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0770 -1.9560 -3.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -2.8870 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 2.0490 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 1.6550 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.8540 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -0.2600 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 0.0740 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -2.5020 -4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -8.7000 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 -5.6880 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -7.4020 -5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 23 -1 M END