IBS-ZINC02154756 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.1480 1.4020 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 0.0000 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -0.6680 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 0.1400 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 1.5430 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 2.1820 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 3.6480 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 4.2220 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 4.2520 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 5.6870 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 6.2400 0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9910 5.8400 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 5.7170 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 6.2660 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 7.7810 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 7.7870 0.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9680 8.2140 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 8.3240 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 9.8350 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 10.2690 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 9.7830 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -2.0990 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -2.8300 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -2.4930 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -4.2530 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -4.3300 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -2.9590 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -2.7580 -0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 1.8690 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.5370 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 2.1100 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 6.0580 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 5.9850 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 4.6220 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 5.9980 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 5.8820 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 5.9100 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 8.1620 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 8.2020 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 8.0800 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 7.8380 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 10.3310 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 10.1530 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 11.3610 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 9.8760 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 10.2080 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 10.0330 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -5.0570 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -5.2110 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 8.2740 0.0970 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4540 7.8880 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 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 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 51 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 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 47 1 0 0 0 0 21 48 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END