IBS-ZINC02266668 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0260 1.4940 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0360 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.4940 -1.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.6880 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -1.1170 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -1.3720 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -1.7520 -4.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -1.1470 -3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.7120 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -0.5010 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -0.7260 -3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.1630 -4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -1.3640 -4.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -1.3770 -5.7740 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -0.5140 -3.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2050 -1.3750 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -1.1710 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 1.1050 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 0.9010 -3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4860 0.4670 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -1.3180 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 -1.0070 -1.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -1.8460 -3.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2890 -2.1490 -3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 -2.7260 -4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3120 -1.8940 -5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7740 -2.4690 -6.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -3.8420 -6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2210 -4.6020 -5.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 -4.0900 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 1.8730 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 1.8630 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8350 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -0.4050 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -0.4150 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -0.5020 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -0.1640 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.7010 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -2.4180 -2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -1.1150 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -1.4570 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 -1.7880 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 2.1480 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 0.8450 -4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 1.1870 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 1.5170 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9430 -0.1330 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 0.1770 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 1.5220 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -2.0250 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 -1.2340 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 -2.8720 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 -0.8240 -5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -1.8520 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0690 -4.2980 -7.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 -4.7450 -3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 0.2440 -2.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 36 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 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 57 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 57 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 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 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 56 1 0 0 0 0 M END