IBS-ZINC04812522 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0100 1.7150 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.2130 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -0.2640 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -1.7660 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -2.2230 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -2.6490 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -2.6580 -2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -3.1040 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -3.5540 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 -4.1150 -2.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 -4.4820 -3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7910 -5.0950 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8920 -5.8320 -4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6050 -6.1500 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8970 -7.1880 -6.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5350 -6.8620 -6.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 -6.5510 -5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 -3.0570 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7660 -3.4160 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -2.6060 1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -2.2120 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -1.8210 2.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 2.0550 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 1.9140 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 2.2480 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.3200 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 0.0140 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 0.2690 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.0660 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -2.2990 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -1.9650 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -3.4570 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -4.2760 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -3.5920 -4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8410 -5.2090 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 -5.9840 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3850 -4.3680 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3960 -5.0020 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9140 -6.7100 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6230 -6.4790 -5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6320 -5.2560 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0560 -7.7060 -6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5010 -5.9890 -6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7880 -7.4400 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 -6.2470 -5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -2.5690 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4970 -5.4620 -4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 47 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 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 M END