IBS-ZINC02387272 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1390 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4850 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -1.8700 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.6280 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0030 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -4.1320 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -4.6270 3.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -5.9820 3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -6.9110 2.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -8.1340 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -9.4370 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -10.5010 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -10.2890 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -9.0080 4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -7.9250 4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -6.5540 4.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -5.8490 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -5.6850 4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -5.0100 4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -4.3940 5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -2.9510 5.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -2.9420 6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -3.6000 5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -2.4850 4.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -1.6420 5.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 1.2180 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1050 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5940 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -4.5420 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -4.4420 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -4.0020 3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -9.6090 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -11.5080 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -11.1320 4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -8.8500 5.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -6.4240 5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -4.8670 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -5.1100 3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -6.6680 3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -6.0420 4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 -4.4390 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 -4.4030 4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 -4.9720 6.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -2.3630 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 -2.5230 6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -1.9140 6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -3.4980 7.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -3.0360 4.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -3.6080 5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -1.0000 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -1.0260 5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -2.2580 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -4.9780 4.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 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 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 M END