NIH-ZINC03958203 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 0.0590 1.1070 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.2710 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -0.9840 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -0.3200 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 1.0570 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.7710 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -1.0980 -0.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4090 -2.0800 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -1.2620 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 -0.8180 -2.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 -1.9010 -3.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -2.1410 -4.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -2.6980 -5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -2.9310 -6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 -2.5960 -6.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 -2.0460 -5.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -1.8300 -4.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -0.3750 0.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -0.7550 1.8480 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -2.1710 1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 0.1240 2.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.3300 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -1.3000 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -1.0000 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 0.2750 3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 1.3410 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.0270 2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 2.1340 2.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 3.3610 2.3590 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 2.6460 2.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 1.6640 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.7900 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -2.0600 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 1.5760 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 2.8470 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -2.1940 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -2.9470 -5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -3.3630 -7.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 -2.7660 -7.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5840 -1.7840 -5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 0.3260 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -2.3310 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -1.8040 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 0.4790 3.7220 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 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 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 M END