PUBCHEM-ZINC03025931 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -1.5840 -1.1160 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -0.1590 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3170 0.2990 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 1.0450 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 0.9950 -2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 2.1410 -2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 3.3050 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 3.2750 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 2.1800 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -0.7970 0.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -0.6360 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -1.3960 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -1.4500 4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -1.3950 5.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -1.4710 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -2.4270 -1.2390 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -1.1540 0.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -1.7890 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -1.0340 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 -1.5670 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 -2.8680 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 -3.6440 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -3.1030 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -4.9380 0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 -5.5050 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -1.9470 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.5850 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -1.5370 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.0900 -2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 2.1220 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 4.2090 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 4.1580 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -1.0020 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 0.4390 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -1.1860 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.4790 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -2.5430 4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -1.0400 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -1.0720 5.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.8990 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.4820 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -1.0700 6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -0.2700 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -0.0120 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -0.9630 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6010 -3.2460 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -3.7560 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 -4.9330 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 -5.5900 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 -6.5160 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -0.9700 4.2130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1720 0.0580 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 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 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 51 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 51 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END