IBS-ZINC02131143 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 0.2820 0.8420 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.4520 -0.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.2570 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.6680 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -1.3870 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -1.6990 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -1.2870 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -0.5640 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 -2.4300 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 -1.7650 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1020 -0.5540 0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -2.5880 0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1700 -4.0940 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -4.5740 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -5.5330 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -3.7650 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -4.2820 -0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1260 -4.8390 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0700 -2.2540 1.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.9330 -2.9100 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5280 -0.8150 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3980 0.0210 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9400 1.3010 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0740 2.5250 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6510 3.5520 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0860 3.3970 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9660 2.1970 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3830 1.1360 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 -0.1540 0.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3160 -0.5430 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 -0.3900 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7440 -1.9240 3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 1.4000 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.0460 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 1.4710 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.4250 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -1.7070 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -1.5300 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -0.2400 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9790 -2.2830 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7380 2.6560 3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7710 4.5120 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5340 4.2400 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3100 2.0880 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7810 0.0120 3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4040 -0.0180 4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1370 -2.2460 4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7550 -2.3160 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 -2.4340 2.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8810 -3.4010 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 49 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 49 50 1 0 0 0 0 M END