IBS-ZINC04337512 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8050 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.5560 -0.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -2.3060 -2.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -3.7580 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.0850 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 -3.2640 -4.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -1.8340 -3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -1.4140 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -3.6450 -4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 -2.9930 -5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 -3.4230 -5.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -2.5770 -6.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 -2.5220 -7.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 -1.5890 -8.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 -0.7080 -9.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 -0.7540 -8.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -1.6870 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -1.9530 -6.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 -1.4780 -6.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4830 -1.5320 -9.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5240 -0.5440 -10.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 -4.4260 -5.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5850 -5.0090 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -4.6320 -3.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -4.2780 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -4.0690 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -3.8690 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -5.1400 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 -1.6490 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -1.2560 -4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -1.5050 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -0.3840 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 -3.2050 -7.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3950 0.0180 -9.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 -0.0650 -8.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7090 -0.7190 -11.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4160 0.4470 -10.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4760 -0.6070 -11.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -5.8190 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 27 2 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 M END