IBS-ZINC05274292 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.7240 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -2.1230 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7150 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.0010 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.6740 -1.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -2.6600 -2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -1.7070 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -2.4740 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -3.4130 -4.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -4.3650 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -3.5980 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.0780 -5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -5.0120 -6.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -5.6660 -7.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -5.3630 -8.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -4.4250 -8.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -2.9520 2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -2.1680 3.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2100 -1.9620 3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -0.8450 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.0250 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 1.1640 2.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -2.9810 4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -3.3670 5.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -4.1120 6.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -4.4730 7.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -4.0890 6.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -3.3370 5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -2.9560 5.4440 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.8640 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.8540 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -1.1320 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -1.0320 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -1.7720 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -3.0280 -4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -5.0410 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -4.9410 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -4.3010 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -3.0440 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -5.2240 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -6.3960 -7.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -5.8560 -9.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -4.1860 -8.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.8450 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -3.2490 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.3090 4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -1.0420 3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -3.0860 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -4.4130 6.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -5.0550 8.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -4.3710 7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -3.8120 -6.9560 N 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 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 55 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 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 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 M END