IBS-ZINC05248662 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 1.0180 -3.4030 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -3.3520 3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -3.2280 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.1820 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -3.2600 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -3.3840 1.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -3.4390 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -3.5690 3.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -3.6070 2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -3.4830 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -3.4770 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -3.4030 -0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 -3.5590 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -4.6860 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 -4.3250 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3680 -5.1180 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5880 -2.9890 0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -2.4010 0.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1190 -1.8510 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -1.4850 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 -0.2620 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 0.5780 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 0.1960 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 -1.0270 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -1.8690 -2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8540 -2.2520 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 -2.0800 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1900 -1.3600 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4060 0.0370 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -5.9460 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -3.7470 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -3.3270 5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -2.5740 5.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -4.3460 5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -3.1640 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -3.0830 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.2240 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 0.0370 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 1.5340 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 0.8520 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 -1.3260 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -2.8260 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 -1.2720 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6060 -2.8080 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4640 -3.0600 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -1.5240 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5050 -0.8970 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3800 -2.3910 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1280 -0.8060 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0270 0.0210 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6920 0.5500 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3610 0.5610 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -6.6310 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -2.7600 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -4.3510 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -4.2300 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5910 -1.3410 1.6020 N 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 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 57 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 57 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 57 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M END