CHEMDIV-ZINC06857992 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.8320 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -1.2180 -3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -1.1000 -2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.6230 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -0.4030 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -0.6500 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -1.1170 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -1.3480 -3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.6840 -4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -3.2120 -4.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -3.6790 -6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.8690 -7.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -4.9960 -6.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -5.4490 -7.7460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5010 -4.7870 -8.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -6.8700 -7.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -7.4030 -9.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -7.6350 -9.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -6.4080 -8.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -5.4070 -8.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -4.3050 -7.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -4.2050 -7.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -5.2090 -8.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -6.3030 -8.8930 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 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 -0.9970 -0.8060 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -0.0400 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 -0.4790 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -1.3060 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -1.7100 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -1.2670 -5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -1.3500 -5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -3.6290 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -3.5460 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -5.6440 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -6.8580 -7.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -7.5050 -7.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -6.6740 -10.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -8.3430 -9.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -7.8660 -10.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -8.4750 -8.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -3.5200 -7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -3.3450 -7.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -5.1350 -8.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -7.0870 -9.4230 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 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END