IBS-ZINC05149834 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.9790 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.4180 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.8900 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2260 -2.3240 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -2.2760 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -2.4810 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -1.6400 3.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -2.0870 4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -3.4570 4.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -4.3090 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -3.7900 2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -5.6800 3.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -6.3810 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -7.2250 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -7.3990 3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -6.0340 3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -3.9940 5.7270 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6470 -4.2860 6.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -4.1440 5.7440 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8950 -1.2000 5.3290 N 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 1.7490 -0.0900 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.2100 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -2.0260 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.5070 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -3.3620 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -1.9010 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -1.8410 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -7.0320 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -5.6560 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -8.1920 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -6.6900 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -8.2150 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -7.5540 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -5.2830 3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -6.1290 4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -0.2460 5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -1.5320 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END