IBS-ZINC02201117 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 0 0 0 0 0 0999 V2000 0.0260 1.8100 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 0.2890 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.1610 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -0.1920 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -0.0020 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -0.9360 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -0.6680 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 0.5170 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 1.1770 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 2.3390 -4.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 3.2410 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 2.9110 -6.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 1.7540 -6.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 0.8400 -5.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 4.3960 -4.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7480 5.3590 -4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0590 6.5420 -4.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8230 7.6310 -4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2660 10.0950 -4.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1130 8.6620 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 2.4420 -2.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 1.3360 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 1.1470 -1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -1.6580 -4.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -2.5900 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -3.1470 -3.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.1920 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -3.7790 -5.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.8860 -4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 2.1300 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 2.1510 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 2.3240 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.1630 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 0.2670 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -1.2520 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 0.1490 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -1.2440 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 0.3510 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5400 1.5370 -7.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 4.5390 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1990 5.7140 -5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6830 4.9010 -5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6350 6.1840 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1220 6.9530 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2420 7.9660 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8090 7.2970 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1840 9.9630 -5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 10.2450 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3530 10.9370 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8490 7.8160 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0580 8.4830 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1650 9.5710 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -2.2490 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -1.1360 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -1.9330 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -2.7220 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -3.4540 -6.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -4.4810 -5.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -4.3470 -5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.9950 -4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.5540 -4.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -1.5730 -5.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 8.8440 -3.8700 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.1480 9.0000 -3.3570 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 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 23 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 63 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 63 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 63 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END