IFLAB-ZINC02457611 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.0630 0.2050 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -1.1210 -1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -1.6080 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -0.8820 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -1.5030 -4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -2.8610 -4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -3.5870 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -2.9590 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -5.3170 -2.9990 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -5.5760 -3.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -5.6490 -1.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -6.1130 -4.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -6.0400 -5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -7.1550 -6.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -7.1030 -5.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -7.0240 -4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -5.9320 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -7.1360 -6.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -7.1790 -8.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -7.2490 -6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -8.5390 -6.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -8.7450 -5.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -7.6700 -5.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 -6.3900 -6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -6.1560 -6.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -4.7560 -6.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -4.3940 -6.2720 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4990 -3.5230 -5.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -2.8210 -6.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 0.9320 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 0.3100 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 0.4140 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 0.1730 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -0.8870 -5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -3.5190 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -5.0660 -5.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -6.1760 -5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -7.0930 -7.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -8.1350 -5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -6.8420 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -8.0050 -3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -6.0040 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -4.9430 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -9.3830 -6.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -9.7430 -5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -7.8260 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8120 -5.5600 -6.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -3.5210 -7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -2.4710 -6.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -1.9950 -6.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 -4.0350 -7.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 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 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 2 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M CHG 1 27 -1 M END