IBS-ZINC02318798 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0410 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -2.7410 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -4.1230 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -4.8050 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -4.1050 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -2.7220 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.0480 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 1.1660 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 1.8560 -0.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 1.6650 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 3.0580 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 3.5650 -3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 4.9590 -3.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 5.4660 -4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 6.8590 -4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3450 7.3440 -5.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6520 7.1400 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4200 6.5320 -4.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9980 7.7780 -6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1620 7.8930 -7.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1460 8.5790 -8.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9760 9.1480 -9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 9.0420 -8.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8040 8.3590 -7.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7750 8.0580 -6.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 8.3970 -6.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -2.2080 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -4.6700 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -5.8850 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -4.6370 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -2.1750 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.6010 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 1.7160 -3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2710 0.9830 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 3.0080 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 3.7410 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 3.6160 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 2.8830 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0210 4.9080 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 5.6410 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 5.5160 -5.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 4.7830 -4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 6.8080 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 7.5420 -3.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0800 7.4500 -7.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0530 8.6680 -9.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9750 9.6800 -10.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 9.4890 -8.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 2 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 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 M END