PUBCHEM-ZINC05113181 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 40 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.5850 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8100 3.9360 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 4.1060 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 4.8120 -0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 4.0720 -1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 3.5210 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 5.2870 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 5.9760 -0.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 5.7880 -2.5500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9280 4.9680 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 6.3300 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 6.9330 -5.0100 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 7.5250 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 8.0660 -7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 8.0540 -7.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -2.3610 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 7.1490 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 5.5340 -3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 8.3140 -5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 6.6990 -6.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 6.5110 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0020 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -2.3770 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 3.7860 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 8.5620 -8.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 6.8600 -2.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 7.6310 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 8.8980 -8.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 4.1440 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 26 34 1 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 36 41 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M END