IFLAB-ZINC05258114 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.0620 1.5020 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.7140 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0940 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.0560 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.6750 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.7860 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -6.8660 2.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2660 -6.3620 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -8.3510 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -9.1070 3.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -6.5120 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -6.2300 5.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -6.1420 6.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -5.8600 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -5.7720 9.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -5.4900 9.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.8810 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.8720 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8430 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.1870 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.6470 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.1190 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.9780 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -2.1760 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7330 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.6510 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -5.7060 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -7.4550 5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -5.2860 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -7.0350 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -7.0860 7.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -5.3360 7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -4.9160 7.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -6.6660 7.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -6.7160 9.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -4.9660 9.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4380 -4.5460 9.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -6.2960 9.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -4.7090 11.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -8.8340 1.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -6.5960 3.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -5.7570 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 -5.4060 11.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -5.2200 11.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -9.7940 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 49 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 51 1 0 0 0 0 47 51 1 0 0 0 0 48 53 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M END