PUBCHEM-ZINC02548989 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 -0.0320 1.7150 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 0.4170 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.4410 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -0.0390 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.2690 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 2.1430 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 1.6020 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 0.7210 0.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -0.4970 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -0.9160 0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -1.4250 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -1.0430 2.6120 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8610 -1.7860 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0620 -2.8090 1.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3930 -3.1950 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9860 -4.2520 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3480 -4.5260 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1230 -3.7720 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5590 -2.7200 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1910 -2.4490 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2210 -1.2400 3.3140 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 3.6720 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 3.3280 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3610 4.1690 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4370 5.3660 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 5.7260 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 4.8810 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 5.2130 -1.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7160 3.7430 1.8100 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0810 5.0400 2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 2.8100 2.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 2.3960 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 0.0690 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.4540 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 3.1700 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 -2.4650 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 -1.3110 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -4.8480 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8030 -5.3370 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1800 -4.0020 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1630 -2.1260 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 2.4160 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3070 6.0090 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 6.6560 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 6.0500 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6870 3.1610 0.8870 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0320 2.8880 -0.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 3.3430 -1.0250 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 46 -1 M END