IBS-ZINC05500065 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 68 0 0 1 0 0 0 0 0999 V2000 -0.4570 1.7910 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 0.2940 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -0.3540 0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -1.7240 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -2.5370 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -3.9260 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -4.5240 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -3.7090 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -2.3150 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -1.4500 0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -1.9820 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -6.0200 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -8.1160 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -8.6030 2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -10.1210 2.8020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1920 -10.3350 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -10.9790 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -12.4830 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -13.3490 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -14.8320 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -13.0650 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -10.4670 4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -10.9010 4.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -11.2450 6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -11.1640 6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -10.7240 6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -10.3770 5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -11.5390 8.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -11.5390 9.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 2.3380 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 2.1280 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 2.0490 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 0.0630 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -0.0170 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.1200 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.5290 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -4.1790 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -1.1470 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 -2.4830 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -2.6560 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -6.3070 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -6.4700 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -8.5210 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -8.3520 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -8.3520 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -8.0490 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -10.6590 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -10.8050 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -12.8150 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -12.6580 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -13.1370 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -15.1070 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -15.4630 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -15.0660 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -13.1860 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -12.0490 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -13.7500 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -10.9870 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -11.5870 6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -10.6430 7.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -10.0440 4.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -11.8880 10.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -12.2300 8.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -10.5280 9.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -6.6270 1.1920 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0230 -6.3580 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -6.1960 1.7560 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 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 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 65 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 65 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 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 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 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 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 65 66 1 0 0 0 0 65 67 1 0 0 0 0 M CHG 1 65 1 M END