IBS-ZINC04064607 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7120 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.6980 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9910 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6670 -1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6550 -2.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.9420 -3.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.6210 -3.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 0.1200 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.3320 -4.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -0.5100 -5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -1.8920 -5.9120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3180 -2.4520 -6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -2.5970 -4.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -3.9600 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -3.9040 -5.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -5.3060 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -6.0130 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -7.2460 -6.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -7.9340 -6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -7.3640 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -6.1560 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -5.9900 -2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -7.0040 -2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -8.1990 -2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 -8.3820 -4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -1.7370 -5.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -2.1980 -4.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.9080 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1960 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.6250 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -0.6180 -6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.1190 -6.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -4.4860 -5.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -4.4870 -3.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -3.3780 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -3.3770 -6.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -5.6610 -7.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -5.0640 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -6.8760 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -8.9920 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -9.3160 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -3.1180 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -3.8470 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.3470 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -1.0870 -6.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -1.0130 -6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 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 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 47 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 51 52 1 0 0 0 0 M END