IBS-ZINC05180243 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.0700 1.2110 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.3040 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.6270 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.8220 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -1.7600 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -2.2380 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -1.7740 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -0.8280 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -0.3620 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 -2.2800 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -1.8300 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5510 -2.3330 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9140 -3.1560 0.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4140 -1.8830 2.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7560 -2.2790 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4660 -2.4450 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7890 -2.8340 3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4200 -3.0630 2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7110 -2.8970 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3730 -2.4970 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5760 -3.1870 -0.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.7340 -3.5080 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6710 -3.4420 1.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.9340 -3.8880 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1280 -4.2150 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2230 -4.5630 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1030 -4.5760 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9640 -4.2620 -2.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.8970 -3.9200 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 1.5850 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 1.4410 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 1.6860 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -0.7790 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -0.2530 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.1520 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -1.7070 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -2.1170 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -2.9690 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -0.4640 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 0.3660 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6350 -3.0100 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8540 -1.0990 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1050 -1.2860 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9780 -2.2690 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3320 -2.9620 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8230 -2.3630 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1940 -4.1980 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1610 -4.8220 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9560 -4.8470 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9830 -3.6650 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 M END