IBS-ZINC02112767 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 2.3420 -1.5930 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -1.4880 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -2.2280 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.1320 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.2970 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -0.5550 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.6440 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.1110 -2.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -0.5040 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -1.6980 -3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 0.2930 -4.8100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4820 1.0300 -4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 0.9990 -5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 0.6080 -5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 1.4980 -5.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 1.4270 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 2.5120 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 2.2460 -4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 3.1170 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 4.2400 -3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 4.5020 -3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 3.6460 -4.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 5.0920 -2.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 6.2340 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.6070 -5.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -0.7200 -6.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.9260 -7.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.6630 -6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -2.2180 -6.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 0.3550 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -2.4660 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -0.6950 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -1.6940 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -2.8820 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -2.7120 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -1.2250 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 1.0760 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -0.2800 -6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 2.9150 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 5.3830 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 3.8600 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 6.8290 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 5.9070 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 6.8380 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -0.9670 -6.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 0.1400 -7.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -2.8650 -7.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -1.7520 -8.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 1.3670 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 0.3550 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 0.0000 -0.2970 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 M END