PUBCHEM-ZINC06201745 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 0.2410 1.7470 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 0.2520 -0.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5570 0.0400 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.2950 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.8480 1.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -0.1230 -1.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -0.6190 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -1.5980 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -0.9680 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -0.4270 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 0.5190 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -1.9720 -4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -3.1780 -4.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -1.3890 -5.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -2.1040 -6.9450 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8210 -2.9570 -7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -2.5900 -6.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -1.1790 -8.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 0.0130 -7.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.4820 0.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -0.5320 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 0.0370 -0.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -1.3080 1.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.5420 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -0.2350 1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -2.4550 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 -2.2780 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 2.1510 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 2.3060 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 1.9490 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -1.1070 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 0.2490 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 -2.4990 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -1.9160 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -0.1340 -3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 -1.2650 -3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 0.1000 -4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 1.4110 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 0.8600 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -0.3890 -5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -3.2530 -6.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 -1.7480 -6.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -3.1440 -7.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -0.9950 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 0.3180 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 -0.4260 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 0.4300 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -3.3870 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -2.7070 3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -1.9750 3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -1.6490 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -2.5980 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -3.1620 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -1.7120 -9.3170 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 54 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 54 -1 M END