IBS-ZINC02428209 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -2.2280 -2.0190 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.5780 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 0.3420 2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.8030 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -1.2800 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -1.5900 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -1.4240 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.9440 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -0.6320 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -1.7550 -4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -2.1720 -5.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -1.5940 -6.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -1.9220 -7.3830 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5450 -1.6760 -7.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -1.1160 -8.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 0.3520 -8.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 1.0710 -8.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 2.3690 -8.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 3.0770 -8.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 2.5210 -7.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 1.2630 -7.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 1.1120 -6.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 2.1890 -5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 3.4320 -5.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 3.6040 -6.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -3.3950 -7.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -4.1000 -6.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 -3.9280 -8.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -5.2620 -9.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -2.0790 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -2.6740 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -2.3300 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -0.2670 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 0.0310 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 1.3690 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 0.2820 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -1.4080 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -1.9600 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.8150 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -0.2570 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -1.2610 -6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -1.2950 -8.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -1.4250 -9.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 0.6820 -9.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 0.1480 -6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 2.0720 -5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 4.2740 -5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 4.5750 -6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -3.3630 -9.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -5.8160 -8.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -5.5140 -9.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 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 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 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 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 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 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END