NIH-ZINC04040405 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -2.4490 -1.2640 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -1.2280 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.8560 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.9680 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -1.3830 -0.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -1.5430 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -1.5520 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -2.0020 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.1120 -1.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -2.2940 -3.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -2.7330 -4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -0.6720 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.4310 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.4620 3.6350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8670 -0.9140 4.8220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7220 -1.5610 5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.9040 5.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.3620 5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -1.4540 6.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -1.7420 4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -2.1860 3.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.4500 7.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -1.6330 8.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -2.3190 10.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -1.8040 11.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -0.8790 11.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 0.2450 10.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -0.2490 9.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 0.4850 4.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.5710 4.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 2.8550 4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 3.0560 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 1.9750 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 0.6850 3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -0.3820 3.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -0.1010 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.7500 2.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 -0.2960 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -2.0370 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -1.4860 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -2.9340 -5.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -3.6420 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -1.9530 -4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -1.5960 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -0.2440 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 0.0360 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.0410 7.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 0.3200 7.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.0420 7.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -2.4030 8.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -2.9800 10.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.8660 9.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -2.6420 12.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -1.3040 12.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 0.8890 10.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 0.8050 11.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -0.7630 8.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 0.6000 8.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 1.4160 5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 3.7020 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 4.0610 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 2.1320 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -1.0370 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 0.4800 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 0.4680 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.3790 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -1.1780 9.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 37 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 66 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 67 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 M END