IBS-ZINC05428212 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.5980 2.8620 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.3840 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 0.8640 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.4910 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -1.3270 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -0.8080 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 0.5470 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 1.1130 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 0.0580 -3.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 0.4000 -4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 1.7290 -4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 2.0840 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 1.1070 -7.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -0.2320 -6.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.5760 -5.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -1.1880 -7.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 1.4830 -8.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 2.3030 -9.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 2.3220 -10.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 1.5760 -10.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.1090 -9.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 2.9900 -8.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 2.2580 -7.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 2.8990 -7.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 4.2720 -7.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 5.0090 -7.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 4.3720 -8.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 6.3550 -8.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 7.0470 -8.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 4.9000 -6.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 4.0830 -5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 3.3660 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 3.0270 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 3.2620 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.5180 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.8970 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -2.3860 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -1.4610 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 1.5920 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 1.8470 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 2.4840 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 3.1170 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -1.6060 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -1.3370 -8.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 2.8520 -11.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 1.1880 -7.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 2.3300 -6.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 4.9430 -9.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 8.1110 -8.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 6.9000 -8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 6.6590 -9.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 4.7070 -5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5230 3.3390 -6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 3.5790 -4.9460 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END