NIH-ZINC02939312 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.2090 0.8080 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -0.5490 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -1.2580 -1.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -0.9740 -1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.2730 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.8540 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.1350 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -4.8430 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -4.2640 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -2.9760 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -4.9790 -0.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 -4.3190 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -3.1100 -0.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -5.0840 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 -4.8210 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4920 -3.7950 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7100 -3.1310 -0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4880 -2.4530 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 -3.4800 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7760 -2.2410 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1410 -1.5120 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2030 -0.6300 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8680 -0.5070 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4520 -1.2610 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -6.1050 0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -6.6360 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 0.9750 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 0.8530 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 1.5770 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -0.3810 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.3040 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -4.5850 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -2.5230 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -5.9490 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -5.6410 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -5.7780 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6530 -5.5790 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1830 -5.2940 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2160 -3.0520 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4080 -4.3000 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 -1.6950 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6710 -1.9800 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -2.9750 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6360 -4.2220 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6020 -1.6330 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5090 -0.0510 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7010 0.1730 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9660 -1.1680 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -6.0040 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -7.6460 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -6.6640 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1430 -4.1440 -0.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4310 -2.0910 -1.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 M END