IBS-ZINC06754827 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -2.7480 0.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 -1.8260 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -4.0380 -0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 -2.9850 1.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 -1.9740 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 -1.6100 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 -2.8850 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -3.8230 3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -4.2130 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -2.5280 5.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -1.3690 5.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -3.4970 6.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -3.1500 7.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -4.4240 8.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -5.2470 7.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -1.0840 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 -2.3770 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -1.1250 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 -0.9330 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -3.3830 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -3.3160 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 -4.7200 4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -4.7950 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -4.8020 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -4.4240 6.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -2.6510 7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -2.4840 8.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -4.1600 9.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -4.9690 8.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -6.0740 8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 M END