NIH-ZINC06577850 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.3520 0.9900 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4040 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.7630 1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.9820 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.8130 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.0520 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -4.4650 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -3.6420 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.4000 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -1.5660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -2.0970 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -3.3020 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -1.1950 -0.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2610 -0.5700 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -0.3080 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 0.6320 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8990 -0.1980 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7810 -1.1560 -0.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6130 -2.0460 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9430 -1.2320 -1.3560 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.8600 -2.5340 -1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1320 -0.7070 -0.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4690 -0.1090 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1500 -0.5750 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7720 0.2950 -4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7130 1.6380 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0360 2.1550 -3.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4250 1.2730 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7390 1.7600 -1.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7000 3.0470 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 3.9690 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9880 3.5370 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.2640 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 1.7130 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 0.9870 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.4000 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.1270 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.4930 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -4.6980 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -5.4340 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 -3.9680 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -0.6060 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5150 -0.9330 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 0.2810 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 1.2800 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 1.2400 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0390 -0.7380 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7500 0.4600 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -2.6060 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 -2.7370 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1890 -1.6370 -4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5240 -0.1010 -5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 2.3030 -5.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9610 3.4020 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3100 5.0240 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6990 4.2380 -3.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 M END