IFLAB-ZINC05144858 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -2.5710 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -2.7140 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -4.0630 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -2.9820 1.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -3.9110 1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -3.2700 2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 -1.5400 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -1.2830 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -0.1560 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 0.7280 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 0.4620 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -0.6710 2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 1.9380 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 2.1660 3.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5910 2.7880 4.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 3.9240 4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 4.8500 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 5.9330 5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 5.8140 5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8320 4.3620 4.4660 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.8660 6.7950 5.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 7.0810 6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 4.7550 6.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 4.6800 6.4940 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 0.5120 -0.3560 -0.8950 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -2.6630 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -1.9090 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -4.8670 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -4.1690 -2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -4.1130 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 -1.9670 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2880 0.0440 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 1.1420 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -0.8800 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 2.6060 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8150 7.5600 4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8190 6.2700 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7800 7.2640 6.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 7.8860 6.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0210 7.4450 7.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 6.7420 7.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 3 0 0 0 0 M END