IBS-ZINC02256306 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 0 0 0 0 0 0999 V2000 -3.6580 1.5330 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 0.7500 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 0.4630 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.2700 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -1.4630 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -2.3420 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -3.7710 1.1370 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9430 -4.1990 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -5.5460 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -6.4740 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -6.0060 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -4.6660 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.1970 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -4.1040 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -3.6360 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -3.2790 -3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -3.4080 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -3.8670 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -2.8260 -5.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -2.5300 -5.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -2.0900 -7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -7.8850 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -8.2380 3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -9.5810 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -10.6050 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -10.2720 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -8.9270 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -11.8680 3.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -12.9570 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -14.2480 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -3.2740 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 2.2080 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 2.1420 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 0.8620 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 1.3960 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 0.1810 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 0.5190 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.4790 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -0.3670 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 0.2890 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -1.2670 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -1.0850 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -2.0300 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -1.9840 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -2.3140 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -5.8760 3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -6.6890 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -4.3900 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 -3.5590 -3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -3.1650 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -3.9730 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -1.7160 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -3.4210 -5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -1.8500 -7.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -2.8790 -7.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -1.2090 -7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -7.4750 3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -9.8320 4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -11.0320 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -8.7050 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -12.9120 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -12.9350 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -15.1170 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -14.3100 2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -14.2880 4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -3.0520 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -3.7240 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -2.3440 3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -0.2400 -0.1000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3270 -0.5680 -1.0400 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 35 1 0 0 0 0 2 36 1 0 0 0 0 2 69 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 69 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 69 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 69 70 1 0 0 0 0 M CHG 1 7 1 M CHG 1 69 1 M END