NIH-ZINC04195811 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9620 -1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.6230 -2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -2.0040 -3.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -4.1300 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -4.6230 -3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -6.1530 -3.5600 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0610 -6.5310 -3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -6.6400 -4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -7.3240 -4.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -6.3160 -6.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -6.7900 -7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -6.2840 -8.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -6.7790 -9.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -6.6360 -2.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -8.0300 -1.6520 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -8.2440 -0.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -7.9210 -1.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -9.3520 -2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -10.0240 -2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -11.0610 -3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -11.4260 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -10.7540 -4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -9.7200 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -12.5550 -5.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.4570 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -4.4910 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -4.5070 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -4.2620 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -4.2460 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -5.7690 -6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -6.4120 -7.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -7.8790 -7.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -6.6620 -8.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -5.1950 -8.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -6.4010 -9.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -7.8690 -9.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -6.4190 -10.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -6.1400 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 -9.7400 -2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -11.5860 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -11.0380 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -9.1970 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -13.4950 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -12.3800 -6.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -12.6080 -5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 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 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 7 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 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 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M END