IBS-ZINC05157922 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.1540 1.3270 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.2000 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.6100 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 0.2360 1.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -1.9160 1.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.3120 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -2.5930 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -1.6260 4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -1.9000 5.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -3.1110 5.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -4.1370 5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -3.9140 3.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -4.9490 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -6.1700 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -6.3930 4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -5.3900 5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -1.0160 6.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -2.8940 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -3.3720 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -4.3370 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -4.8290 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -4.3580 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -3.3940 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -2.9340 1.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -3.4920 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 1.7480 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 1.6230 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 1.6960 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -0.6200 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.5690 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -3.2100 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -1.5060 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -0.6430 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -4.7840 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -6.9700 2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -7.3640 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -5.5730 6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -3.2660 6.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -2.9890 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -4.7080 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -5.5830 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -4.7440 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -3.0390 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -3.2940 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -4.5680 2.3090 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 18 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 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 38 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 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 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 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END