IFLAB-ZINC03866383 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.0180 1.6120 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.3140 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -0.4300 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.1190 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 1.4240 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 2.1660 -1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -0.6890 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 -1.1720 -1.7440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5890 -0.3320 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -1.8660 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.1320 -1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -2.1060 -2.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -1.7210 -3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -0.5930 -4.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -2.7610 -4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.6050 -5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -3.5180 -6.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -4.5960 -5.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -4.7510 -3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -3.8350 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -5.7050 -5.9430 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -6.2310 -4.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -5.0080 -7.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -6.9710 -6.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -7.8830 -5.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -9.1780 -6.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -8.9040 -7.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -7.9020 -8.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -6.6260 -7.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 2.1890 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -0.1240 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.4450 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 1.8630 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 3.1750 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -0.0690 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -1.5500 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -3.0760 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -1.7580 -6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -3.3680 -7.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -5.5660 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -3.9530 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -7.3990 -5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -8.1290 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -9.8390 -5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -9.7060 -6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -8.5100 -7.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -9.8400 -8.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -7.6590 -9.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -8.3600 -8.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -5.9680 -8.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -6.1040 -7.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 -1.0970 -0.8670 O 0 5 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 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 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 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 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M CHG 1 52 -1 M END