IBS-ZINC05576887 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 3.3840 0.2660 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -1.0320 -2.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -1.4260 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -0.5810 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 -0.9760 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -2.2150 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -3.0760 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -2.6750 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -3.5040 -1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -4.4060 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -4.9310 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -6.1320 2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -6.7190 4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -7.9430 4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -8.6230 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -8.0810 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -6.8250 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -6.2140 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -5.0230 0.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -6.8300 0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -6.1400 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -6.8250 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -6.1290 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -4.7310 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -4.0460 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -4.7500 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -3.9810 -3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -4.5780 -4.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -2.6340 -3.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -1.9620 -4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 0.3150 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 0.4540 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 1.0180 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 0.3900 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.3120 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -2.5190 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -4.1390 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -6.2040 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -8.3940 5.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -9.5920 4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -8.6180 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -7.9050 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -6.6620 -3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.9660 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -4.2220 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -0.8820 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -2.2510 -5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -2.2470 -4.9770 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 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 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 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 30 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 M END