IBS-ZINC02128955 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 1.0950 1.4090 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.0730 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.6280 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -1.9830 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -2.7980 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -2.2300 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.8720 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.9160 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -6.3840 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -7.0000 -0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -7.0480 -2.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -8.5080 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -9.1320 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -10.5110 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -11.1410 -4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -10.3940 -5.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -9.0240 -5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -8.3860 -4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -6.8860 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -6.3870 -3.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0460 -6.6670 -4.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -4.8970 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -4.2540 -4.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.2270 -2.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 1.6140 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.7520 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 1.9340 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 0.0020 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -2.4150 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.8520 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -0.4310 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -4.7710 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -8.8960 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -8.7540 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -11.0940 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -12.2130 -4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -10.8810 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -8.4430 -5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -6.4430 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -6.5820 -5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -3.2580 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 42 1 0 0 0 0 M END