IFLAB-ZINC04519012 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.8650 -1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -4.8790 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -5.0080 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1600 -4.6800 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -6.5290 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -7.1590 -1.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -8.5020 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -9.1900 -0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -9.1440 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -8.4560 -3.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -10.4870 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -11.1170 -3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -12.6380 -3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -13.2960 -4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -15.4150 -5.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -15.2510 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -4.3600 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 -3.5080 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -3.1500 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -3.8050 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -4.5410 2.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -6.8580 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -6.8160 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.6090 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -11.0370 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -10.7890 -4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -10.8300 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -12.9660 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -12.9250 -3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -12.9680 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -13.0090 -4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -15.1560 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -15.0830 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -16.4960 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -14.7990 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -14.9850 -3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -16.3350 -3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -3.1630 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -2.4790 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -3.7510 4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -14.7560 -4.5120 N 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 56 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 56 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 M END