IFLAB-ZINC02707499 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2180 -0.6690 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -2.1400 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.9480 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -4.3200 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -4.8940 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -4.1040 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -2.7210 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -1.9450 0.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.6950 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -0.2200 -0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.0700 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4580 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.1030 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 3.8640 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 4.3080 -0.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 4.2270 -0.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 4.3460 1.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 5.6340 1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 6.0970 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 7.3870 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 8.2280 2.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 9.0740 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 7.9240 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 6.6630 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -6.6480 -0.0630 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -6.9490 0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -7.1770 0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -7.0880 -1.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -8.3630 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -8.7900 -3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -10.1020 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -11.0000 -2.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -11.8860 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -10.6960 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -9.4140 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.8990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5610 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.5010 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -4.9480 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -4.5620 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 2.0290 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 5.4250 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 7.7560 4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 8.7020 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 6.4160 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -8.0730 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -10.4440 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -11.4890 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -9.1680 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 2 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 26 1 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 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 37 1 0 0 0 0 32 33 2 0 0 0 0 32 48 1 0 0 0 0 33 34 1 0 0 0 0 33 49 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 2 0 0 0 0 36 50 1 0 0 0 0 37 51 1 0 0 0 0 M END