IBS-ZINC02115936 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0220 -0.3780 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.4980 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 0.1290 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -0.2920 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -1.3520 3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -1.9730 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -1.5460 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -2.2490 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -1.9310 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.4720 -1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0990 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -0.4440 -3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.0390 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -0.5290 -5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -1.2000 -5.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -1.1380 -4.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -1.5250 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -1.7750 -6.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -1.6860 -7.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -1.0240 -8.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.4440 -7.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 0.2040 -7.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 0.2500 -9.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 0.6520 -4.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 0.9530 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 0.5870 -2.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -1.7740 4.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -2.8670 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 0.3270 4.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 1.4070 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.9510 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -2.7960 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -1.9140 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -3.3250 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -2.2940 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -2.4100 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -2.2930 -6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -2.1360 -8.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -0.9610 -9.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -0.7660 -9.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 0.7940 -9.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 0.7550 -9.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 1.5140 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -3.7380 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -2.5940 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -3.1020 5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 1.8110 5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 2.1890 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 1.0450 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 29 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 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 28 2 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 23 2 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END