IBS-ZINC05321613 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 0.0820 1.2500 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.2140 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.8990 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.2420 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.3770 1.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -4.5150 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.6630 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.5320 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.2990 -0.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -1.0560 -1.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -3.4770 -2.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.5880 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -4.0970 -5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -4.6920 -7.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -5.8570 -8.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -6.7180 -8.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -7.2900 -7.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -6.2040 -6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -5.7710 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -5.8420 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -7.0110 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -8.1050 3.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -8.0300 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -6.8620 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.4070 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 0.5790 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 1.0660 4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 0.5720 5.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.4090 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -0.8970 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 1.7500 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 1.4770 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 1.6750 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -5.6460 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -2.5150 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -5.1970 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -5.2170 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -3.5850 -5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -3.4020 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -4.0670 -7.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -4.0890 -7.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -5.4740 -9.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -6.4390 -8.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -7.9510 -7.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -7.9050 -6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -5.6150 -6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -6.6470 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -4.9930 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -7.0690 4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -9.0140 3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -8.8780 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -6.8190 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 0.9690 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 1.8260 4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 0.9490 6.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -0.7980 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.6630 3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -5.2340 -6.0630 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8600 -5.7630 -5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END