IBS-ZINC02127952 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.3110 1.8480 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.3900 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.1530 -1.3920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4550 0.5210 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.5390 -1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -0.2560 -1.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2810 -0.8460 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -0.9220 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -0.2740 -3.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -2.2360 -2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -2.9100 -3.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -4.3860 -3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -5.0890 -4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 -6.5440 -4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -6.9740 -3.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 1.0870 -0.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 2.0370 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 3.2470 -1.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 3.6530 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 4.9550 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 5.3240 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 4.4170 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 3.1260 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 2.7330 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 1.3710 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 0.5320 1.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 1.8880 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 2.4040 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 2.2890 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.2040 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 0.3330 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -1.4640 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -1.9280 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -2.2110 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -2.7370 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -2.4410 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -2.8270 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -4.8550 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -4.4690 -3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -4.6210 -5.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -5.0060 -4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 1.7710 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 5.6700 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 6.3320 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 4.7250 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 2.4250 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -7.3610 -5.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -8.2860 -5.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 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 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 47 48 1 0 0 0 0 M END