PUBCHEM-ZINC00573481 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.0840 4.3000 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 4.9630 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 5.6440 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 5.6710 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 5.0040 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 4.3220 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.5880 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.8990 -0.1300 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 4.3590 -0.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 5.8040 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 6.1320 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 4.0710 -1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 3.7970 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 5.9480 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7230 6.0750 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 6.6170 -3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 6.8010 -4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 6.3300 2.7600 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9930 6.2470 3.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 6.9520 2.1000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8530 3.7620 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 4.9300 3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 6.1910 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 5.0070 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 6.3180 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 6.1800 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 7.2160 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 5.6930 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 3.5870 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 3.7390 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 2.7240 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 4.2760 -2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 5.2130 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 6.9280 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5910 6.7410 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0130 5.0990 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 5.5630 -1.3460 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4510 6.0270 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 37 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 37 1 M END