IBS-ZINC04029438 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 -0.0330 1.4240 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.0050 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.5920 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 0.1900 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.4100 -3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.7880 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.5700 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9750 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8280 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -3.3070 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -3.1420 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 -3.9280 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -3.4270 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -3.5840 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -2.4400 -4.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7780 -3.4660 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -2.4360 -5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -2.1160 -6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -2.2200 -7.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -2.0110 -9.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -2.2110 -9.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -2.6000 -8.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -2.8140 -7.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.6190 -6.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -2.7390 -5.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -3.0000 -4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -1.7340 -7.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -2.1580 -5.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.8050 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.7940 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.7620 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 1.2670 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1990 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -3.6470 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.8510 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.4320 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -2.7380 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -4.3610 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 -3.5230 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -2.0870 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -4.9880 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 -3.7780 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -4.0120 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -2.3760 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -4.6370 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -3.2150 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -1.7070 -9.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.0590 -10.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -2.7420 -9.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -3.1170 -6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -2.2480 -8.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -0.6560 -7.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -3.2450 -5.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -1.7240 -6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -2.8140 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -1.6860 -4.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -0.6950 -4.7660 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 55 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 55 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 56 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 56 1 0 0 0 0 56 57 1 0 0 0 0 M END