IFLAB-ZINC00958455 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.0350 1.5190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.0110 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.5170 1.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3400 -0.0990 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -2.0440 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -0.1040 1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 0.1070 2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.0470 3.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 0.5370 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 0.7000 3.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -0.3520 4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 -0.2680 5.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 0.8740 6.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 2.0190 5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 1.8980 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 2.8520 3.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 3.1200 6.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 2.9060 7.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 1.2440 7.9630 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 3.9190 8.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 5.0490 8.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 3.5990 10.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 4.5900 11.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 5.9170 10.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 6.8940 11.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 6.5530 12.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 5.2340 13.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 4.2520 12.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1790 2.8160 12.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 4.4610 6.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 1.9030 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.8800 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.8640 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -0.3940 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.3560 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -2.3540 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.4620 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -2.4040 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -0.2210 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 1.4850 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -1.2970 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 2.6800 10.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 6.1840 9.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 7.9250 11.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 7.3190 13.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 4.9710 14.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 2.3300 12.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7070 2.7790 13.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 2.2980 12.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 4.5140 6.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 5.2510 6.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 4.5880 5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 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 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END