IBS-ZINC05111430 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.1920 1.4660 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -0.0400 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.7760 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -2.1570 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -2.8040 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -2.0620 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -0.6820 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -4.2050 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -4.8430 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.2190 -2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -6.3150 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -7.0370 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -8.5400 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -6.3960 -3.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -7.1630 -4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -6.2020 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -7.0040 -7.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -6.8050 -9.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -5.8020 -10.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -5.0310 -10.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -4.3120 -9.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -5.3000 -8.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -6.9850 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -8.1980 0.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -6.2170 1.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -4.8790 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -4.2450 2.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 1.8270 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 1.8660 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 1.7950 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.2720 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -2.7320 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -2.5630 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -0.1040 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -8.8320 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -8.9350 -3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -8.9420 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -5.4260 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -7.7760 -4.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -7.8060 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -5.5890 -5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -5.5590 -5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -7.6160 -7.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -7.6470 -7.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -7.3550 -9.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -7.5020 -9.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -6.3380 -11.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -5.1390 -10.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -3.7710 -9.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -3.6060 -9.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -5.9730 -8.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -4.7520 -7.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -6.6420 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -6.0810 -8.4120 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 M END