IBS-ZINC05304319 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 0.0680 1.4600 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 0.0470 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -0.5410 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -1.9310 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -2.6600 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -2.0040 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -0.6100 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 0.1180 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 -2.7790 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -2.8990 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -3.8210 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4570 -4.5680 3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4690 -5.9660 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6740 -6.6670 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8860 -5.9790 2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8890 -4.5710 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6750 -3.8760 3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1220 -3.9760 2.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1830 -2.5580 2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1130 -6.5860 2.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1320 -7.9830 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5440 -8.4530 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5330 -7.5290 2.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.3020 -6.5880 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4990 -7.7820 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7860 -9.5940 1.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 1.7640 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 1.7590 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 1.9690 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -2.4500 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -3.7410 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 -0.0730 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 1.1950 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 -2.2830 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -3.7740 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -3.4500 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -1.9160 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 -2.8210 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -4.3590 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5430 -6.5310 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6340 -7.7510 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6570 -2.7900 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2370 -2.2660 2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7810 -2.1890 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6710 -2.1000 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 -8.2200 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7890 -8.5380 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 -3.6520 1.7480 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.3480 -3.1840 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 -4.5890 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 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 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 26 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END