NIH-ZINC06129960 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.1940 1.4020 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.1050 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.7980 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.1800 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.8690 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.1760 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.7940 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -4.6310 0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -5.0390 -1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -5.0440 1.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -5.0930 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -5.2340 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -5.2450 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -5.7930 0.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -5.4440 1.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3820 -4.5910 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -6.6190 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -6.5260 3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -7.6040 3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -8.7740 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -8.8670 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -7.7910 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -6.4830 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -6.7970 2.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 -6.8630 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9100 -8.1950 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7270 -9.0040 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1090 -8.1550 3.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0020 -7.5630 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1770 -6.7390 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 1.7460 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 1.7760 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 1.7730 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.2600 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.7220 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.7140 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.2520 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -4.3880 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -6.1700 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -4.2320 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 -5.8890 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -5.6120 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -7.5320 4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -9.6160 3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -9.7810 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -7.8640 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -5.9620 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 -7.4910 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5680 -8.8510 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5300 -7.4020 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6200 -9.3970 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1240 -9.8300 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3700 -6.9140 4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 -8.3470 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7850 -5.9220 2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 -6.3320 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7480 -7.6030 1.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 23 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 22 2 0 0 0 0 18 19 2 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 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END