IBS-ZINC02094205 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -1.5630 0.2200 0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.2460 0.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4150 -0.2060 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 1.7120 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 2.5170 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 3.9020 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 4.3110 0.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.5380 -1.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5540 -0.2810 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -0.0920 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.3350 -3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.3230 -1.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7370 -1.9470 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -2.1060 -1.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2140 -2.8460 0.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6310 -2.4410 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -4.3460 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -4.6570 -0.9280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1360 -4.3360 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -3.7740 -2.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3780 -3.6910 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -4.4630 -3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -5.7900 -3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -6.3730 -2.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1200 -5.7960 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -6.2080 -1.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3070 -6.8350 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -8.2760 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -8.4020 -1.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4040 -7.8820 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -7.8180 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -9.7730 -1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -10.2500 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -6.9640 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -2.6870 1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -3.2060 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.6080 -1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 0.7510 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.7940 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 0.6940 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 1.6990 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 2.2330 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 2.6790 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 1.9530 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 0.6820 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 0.3320 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -1.1060 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -1.7020 -3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.8120 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -4.8110 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -3.8240 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -4.6590 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -5.6310 -4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -6.5080 -4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -6.8000 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -6.2380 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -8.9480 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -8.6280 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -7.8490 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -8.4580 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -7.0180 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -7.9980 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -6.4870 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.3160 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -3.6920 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -2.1850 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 4.4780 2.5250 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 2 0 0 0 0 6 67 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 35 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 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 M CHG 1 67 -1 M END