IBS-ZINC04026181 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -0.9630 2.4000 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 0.9250 -0.6570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4420 0.7080 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 1.6180 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 1.3510 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 1.1050 -1.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 1.4020 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 0.5240 -1.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6510 0.6440 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.9430 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -1.8130 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -1.4150 -0.3710 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7010 -1.5700 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 0.0620 -0.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2560 0.3480 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 0.2520 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -0.5380 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -2.0330 -1.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6250 -2.2770 -0.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3410 -3.3280 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -2.0210 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -2.6200 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6760 -0.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8830 -2.1000 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -4.1010 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -4.7860 -1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 -4.6710 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -6.0490 -1.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 -6.7060 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6520 -6.1480 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -8.1400 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0110 -8.6480 -2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9900 -10.0820 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9350 -10.6400 -2.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -2.6590 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 3.0140 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 2.5530 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 2.6820 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.9450 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -0.3330 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 2.6610 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 1.4000 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 2.4280 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 1.0340 -3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.2280 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.0790 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -1.6760 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -2.8610 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 1.3090 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.1180 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -0.1800 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 -0.3810 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -2.5370 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -0.9520 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -3.6350 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -1.9980 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -4.6330 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -4.0860 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -8.2040 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0510 -8.7510 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5240 -8.5840 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5360 -8.0370 -3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -1.9800 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -3.6030 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -2.8420 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1420 -10.7390 -2.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0780 -11.6570 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 2 0 0 0 0 33 66 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 66 67 1 0 0 0 0 M END