IBS-ZINC05100643 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0590 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -0.0400 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.2620 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 0.3450 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4380 1.7130 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 1.5590 -4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 2.6280 -4.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 3.8430 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 4.9920 -5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 6.2220 -4.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 6.3670 -3.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 5.2810 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 3.9900 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 2.9140 -2.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 0.2040 -4.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 -0.5090 -3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -1.8740 -3.4750 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -0.3580 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -1.0380 -6.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -1.5910 -7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 -1.4700 -7.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 -0.7850 -7.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -0.2400 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 -2.0610 -9.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 -2.6540 -9.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8920 -1.9300 -9.4040 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.4820 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -2.3460 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -2.4360 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 0.0280 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 4.8960 -6.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 7.1000 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 7.3550 -2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 5.4080 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -2.3110 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 -2.4050 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -1.1310 -6.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -2.1190 -8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -0.6890 -7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7050 0.2860 -5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1570 -0.8740 -9.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1420 -2.4260 -10.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4460 -2.3930 -8.5880 H 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 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END