IFLAB-ZINC04032802 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 0.6480 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 1.0120 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 0.5900 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.1950 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -0.5540 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.0360 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -2.7180 -0.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.6220 1.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -4.0830 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -4.4850 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -5.9880 2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -6.6840 2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -8.1400 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -8.9140 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -10.2880 2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -10.9040 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -10.1570 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -8.7690 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -8.0030 3.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -8.4380 3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -6.6640 3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -6.0190 3.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -10.7770 3.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -12.2020 3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -8.3140 1.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -9.1670 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 0.9780 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 1.6250 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 0.8740 -4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -0.5240 -4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -1.1650 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.0770 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -4.4600 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -4.5050 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -4.1080 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -4.0620 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -6.1730 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -10.8860 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -11.9800 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -12.5660 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -12.6300 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -12.4950 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -9.7260 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -9.8620 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 -8.5620 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 28 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 26 27 2 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END