OTAVA-ZINC04422618 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.1640 0.6580 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -0.7710 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.4650 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.6530 2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -0.5520 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.2980 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -2.2580 3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -2.0950 4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -1.1450 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 -1.0980 4.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6930 -1.9900 3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0800 -1.8610 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8220 -2.7450 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1800 -3.7680 2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 -3.9090 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 -3.0210 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -3.1570 3.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -4.1280 2.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 -4.6860 1.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1860 -4.5640 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6440 -5.6300 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0480 -5.7470 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4880 -6.7160 -1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5310 -7.5720 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1350 -7.4620 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6960 -6.4950 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -0.0310 5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 1.3690 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 0.7610 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 0.9440 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -1.4530 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -1.0420 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.9130 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -2.8980 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -2.2720 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -3.7310 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.0800 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -0.0530 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 0.7750 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -0.6920 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -3.2960 4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -1.6540 4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -1.0660 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8970 -2.6010 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2950 -4.7100 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -0.3840 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4360 -3.5850 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 -4.6890 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2330 -5.0850 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0160 -6.8010 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8730 -8.3260 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9490 -8.1300 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1800 -6.4240 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 -0.2020 6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 0.9300 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 0.0820 5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -0.9810 0.6740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2010 -0.5800 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -1.9890 2.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 57 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 59 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 59 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 7 59 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END