PUBCHEM-ZINC02955282 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 59 0 0 1 0 0 0 0 0999 V2000 -0.4140 1.3780 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 0.0660 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.9980 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -0.7600 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 0.5560 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 1.6420 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 3.0930 0.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6190 3.6920 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 3.6150 1.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0480 3.1740 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 5.1400 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 5.4330 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 4.4280 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 3.3090 2.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2040 2.3320 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 3.3500 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 3.3250 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5930 3.4410 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 3.6180 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 3.6160 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 3.4150 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 3.2610 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 3.1160 -2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 4.0800 -2.9280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7580 5.1060 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 3.9300 -2.6330 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0980 4.8740 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 2.8950 -3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 2.7990 -4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 3.7250 -4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 3.4390 1.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 4.1890 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 4.1290 2.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7450 1.9060 1.1260 N 0 5 0 0 0 0 0 0 0 0 0 0 8.6890 1.5540 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -2.3750 0.4470 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7210 -2.5470 0.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -3.2910 0.5410 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1310 2.1960 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -0.1000 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -1.5710 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 0.7260 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 5.6880 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 5.4090 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 6.3530 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 4.4290 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 3.2310 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 3.7680 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 2.0730 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 3.3000 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 2.3470 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 2.1590 -5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 3.2440 -4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 4.6110 -5.0530 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 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 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 2 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 36 1 M CHG 1 38 -1 M END