IFLAB-ZINC04087915 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8220 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.6720 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0400 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -4.5740 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -3.7440 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -2.3580 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -1.4640 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -0.2580 3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -1.9840 4.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -1.1400 5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 0.1580 5.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 0.7700 6.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 0.0560 7.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -1.6440 6.9010 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 0.6770 8.7360 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 2.4740 8.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 3.1610 9.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 2.5020 10.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 4.5070 9.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 5.1900 10.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4100 6.1980 10.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 7.1360 9.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 6.3250 8.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 5.3180 8.7200 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.2630 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -4.6980 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -5.6450 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.1650 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -2.9460 4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 2.7800 7.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 2.7540 8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 5.7140 11.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 4.4590 11.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8350 6.7790 11.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2050 5.6650 9.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 7.6500 9.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 7.8700 8.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6440 6.9960 7.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 5.7910 7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 4.6720 7.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 5.8530 9.1370 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 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 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 37 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 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END