PUBCHEM-ZINC06322083 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0260 1.6660 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.2790 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.3930 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.2970 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.6840 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.3800 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 3.8820 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 4.4130 1.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 5.7500 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 6.6220 0.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 6.0340 2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 7.2940 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 7.2080 5.1530 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 5.5060 5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 5.0130 3.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 4.6620 6.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3060 3.6050 6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 4.9070 7.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 5.6410 8.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 5.0260 8.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -2.1780 0.4450 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -2.3600 1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.3900 1.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.8380 -1.0010 N 0 5 0 0 0 0 0 0 0 0 0 0 2.1360 -2.5780 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 2.1900 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -0.2680 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -0.2370 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 2.2200 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 4.2690 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 4.2560 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 3.7860 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 8.2340 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 3.9430 7.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 5.4620 6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 5.5190 9.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 6.7140 8.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 4.0260 9.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 5.6580 9.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 4.8600 7.3240 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2780 5.7030 7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 4.0710 7.3110 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 40 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 40 1 M END