NIH-ZINC02454774 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.3840 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.1330 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -0.5890 0.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -1.9140 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.6600 0.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -2.4320 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -3.7430 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 -4.2550 -0.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -3.5950 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -2.2380 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -1.5510 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 -0.2410 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7080 -2.1880 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9240 -1.4000 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1330 -2.2880 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -1.5550 0.3700 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0460 -1.1450 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -0.4050 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 0.8940 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 1.9500 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 1.7050 -2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 0.4000 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -0.6520 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 2.7420 -3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -4.3210 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -4.6390 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.7320 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 1.8680 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 1.6300 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.3800 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -0.6180 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 0.1990 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0110 -0.9980 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8870 -0.5800 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0450 -2.6900 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1700 -3.1080 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0460 -1.6970 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 1.0840 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 2.9650 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 0.2080 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -1.6680 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 3.0080 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -5.3640 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2450 -4.2720 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 -3.8530 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -5.0140 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -5.4780 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -4.0740 -0.6470 H 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 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 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 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END