PUBCHEM-ZINC06193263 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 0.6660 -2.4330 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -2.0960 1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.1010 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 0.1640 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -0.2820 1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 1.1790 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 1.5260 0.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 1.8830 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 3.3480 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 4.3030 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 5.7260 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 6.7440 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 8.0830 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 8.4220 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 7.4040 -1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 6.0730 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 5.0650 -1.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 5.3090 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 3.7260 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 2.8830 -1.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 9.8560 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1510 6.4500 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 1.5130 1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8150 1.4040 1.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 1.5640 3.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 1.2770 4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 1.4220 5.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9340 2.4550 5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 0.9920 6.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -0.4570 6.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -0.4390 6.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 0.5620 5.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.2370 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.4950 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -1.8550 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -2.3310 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -2.6490 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.8340 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.8460 3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 0.8950 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -0.7450 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 0.5700 4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -0.9440 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -0.5300 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 1.3110 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 1.8920 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 1.6670 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 1.2410 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 4.0330 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 8.8780 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 7.6550 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 10.1290 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 10.0240 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 10.5210 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7380 5.8280 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 7.3680 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 5.9410 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 1.8370 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 0.2520 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 1.9640 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 1.1490 6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 1.5540 7.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -1.0770 6.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -0.8430 8.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -1.4040 5.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -0.1490 7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -0.6090 1.7940 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5650 -0.1130 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 67 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 67 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 5 67 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END