#### G N O M --- Version 4.5a revised 09/02/02 #### Thu Dec 08 15:47:38 2011 === Run No 1 === Run title: 08-Dec-2011 (ela_023.dat - 1.0*Aver(ela_022.dat,ela_024.da Number of points omitted at the beginning: 31 Number of points omitted at the end: 1145 To optimize the performance, some input data points have been joined. New number of points equals to 497 ******* Working Directory : ******* Input file(s) : Z:\Users2011\Nowotny.1211\saxs-0\Process Condition P(rmin) = 0 is used. Condition P(rmax) = 0 is used. Experimental conditions for the first run ----------------------------------------- Highest ALPHA is found to be 0.4279E+00 The measure of inconsistency AN1 equals to 0.7746E+00 Alpha Discrp Oscill Stabil Sysdev Positv Valcen Total 0.4279E+03 6.8521 1.1694 0.1914 0.1573 1.0000 0.8701 0.00001 0.8558E+02 2.4913 1.2267 0.0703 0.2500 1.0000 0.8743 0.44331 0.1712E+02 0.8250 1.3143 0.0301 0.7177 1.0000 0.8731 0.57970 0.3423E+01 0.4583 1.3527 0.0093 0.9516 1.0000 0.8722 0.71181 0.6847E+00 0.4189 1.3688 0.0074 0.9597 1.0000 0.8716 0.66606 0.1369E+00 0.4103 1.3895 0.0095 1.0081 1.0000 0.8709 0.10000 0.2739E-01 0.4058 1.4460 0.0170 0.9919 1.0000 0.8707 0.10000 0.5477E-02 0.4022 1.6602 0.0277 0.9919 1.0000 0.8714 0.10000 0.1095E-02 0.4002 2.1023 0.0475 1.0323 0.9996 0.8695 0.10000 0.2191E-03 0.3986 3.4465 0.1160 1.0323 0.9975 0.8565 0.10000 0.4382E-04 0.3974 5.6446 0.0806 1.0242 0.9907 0.8312 0.10000 0.8764E-05 0.3972 7.2792 0.1238 1.0161 0.9847 0.8147 0.10000 0.1753E-05 0.3970 12.0933 0.4376 1.0161 0.9614 0.7570 0.10000 0.3505E-06 0.3964 17.5013 0.9569 1.0161 0.8566 0.3995 0.10000 0.7011E-07 0.3945 16.7152 0.8395 1.0161 0.7469 0.2948 0.10000 0.1402E-07 0.3909 16.6097 0.4773 1.0081 0.7191 0.2893 0.10000 0.2804E-08 0.3889 18.1230 0.2854 1.0081 0.7101 0.2877 0.10000 0.5609E-09 0.3876 23.9692 0.8098 1.0081 0.6954 0.3146 0.10000 0.1122E-09 0.3834 26.2802 0.8263 1.0323 0.7082 0.3173 0.10000 0.2244E-10 0.3689 29.4976 0.8497 1.0484 0.7140 0.3608 0.10000 0.4487E-11 0.3227 32.4595 0.6797 1.0605 0.7287 0.4030 0.10000 0.8974E-12 0.2331 36.9880 0.4851 1.0766 0.7193 0.3566 0.10000 0.1795E-12 0.1368 40.9609 0.3303 1.0685 0.6987 0.3490 0.10000 0.3590E-13 0.0636 45.5246 0.2259 1.0685 0.6985 0.3427 0.10000 0.7179E-14 0.0199 48.8292 0.0975 1.0766 0.7146 0.3165 0.10000 0.1436E-14 0.0046 49.9363 0.0254 1.0847 0.7220 0.3055 0.10000 0.2872E-15 0.0009 50.1923 0.0054 1.0847 0.7237 0.3028 0.10000 0.5743E-16 0.0002 50.2451 0.0011 1.0847 0.7241 0.3022 0.10000 0.1149E-16 0.0000 50.2558 0.0002 1.0847 0.7242 0.3021 0.10000 0.2297E-17 0.0000 50.2579 0.0000 1.0847 0.7242 0.3021 0.10000 0.4595E-18 0.0000 50.2583 0.0000 1.0847 0.7242 0.3021 0.10000 *** Golden section search to maximize estimate *** Alpha Discrp Oscill Stabil Sysdev Positv Valcen Total 0.1851E+01 0.4337 1.3597 0.0075 0.9758 1.0000 0.8719 0.70448 0.4329E+01 0.4753 1.3494 0.0107 0.9355 1.0000 0.8723 0.70903 0.2707E+01 0.4463 1.3556 0.0083 0.9516 1.0000 0.8721 0.70503 0.3745E+01 0.4641 1.3515 0.0098 0.9435 1.0000 0.8722 0.71005 0.3130E+01 0.4532 1.3539 0.0088 0.9516 1.0000 0.8721 0.70931 0.3543E+01 0.4604 1.3523 0.0094 0.9516 1.0000 0.8722 0.71274 0.3618E+01 0.4618 1.3520 0.0096 0.9516 1.0000 0.8722 0.71330 0.3666E+01 0.4626 1.3518 0.0096 0.9597 1.0000 0.8722 0.72562 0.3696E+01 0.4632 1.3517 0.0097 0.9516 1.0000 0.8722 0.71386 0.3648E+01 0.4623 1.3519 0.0096 0.9597 1.0000 0.8722 0.72548 0.3677E+01 0.4628 1.3518 0.0097 0.9516 1.0000 0.8722 0.71373 0.3659E+01 0.4625 1.3518 0.0096 0.9597 1.0000 0.8722 0.72557 0.3670E+01 0.4627 1.3518 0.0096 0.9597 1.0000 0.8722 0.72565 0.3670E+01 0.4627 1.3518 0.0096 0.9597 1.0000 0.8722 0.72565 #### Final results #### Parameter DISCRP OSCILL STABIL SYSDEV POSITV VALCEN Weight 1.000 3.000 3.000 4.000 1.000 1.000 Sigma 0.500 0.600 0.120 0.200 0.120 0.120 Ideal 1.000 1.100 0.000 1.000 1.000 0.950 Current 0.463 1.352 0.010 0.960 1.000 0.872 - - - - - - - - - - - - - - - - - - - - - - - - - Estimate 0.315 0.839 0.994 1.000 1.000 0.657 Angular range : from 0.1718 to 2.8929 Real space range : from 0.00 to 11.57 Highest ALPHA (theor) : 0.428E+03 JOB = 0 Current ALPHA : 0.367E+01 Rg : 0.348E+01 I(0) : 0.774E+02 Total estimate : 0.726 which is A REASONABLE solution S J EXP ERROR J REG I REG 0.0000E+00 0.7744E+02 0.6136E-02 0.7742E+02 0.1227E-01 0.7739E+02 0.1841E-01 0.7733E+02 0.2455E-01 0.7725E+02 0.3068E-01 0.7714E+02 0.3682E-01 0.7701E+02 0.4295E-01 0.7686E+02 0.4909E-01 0.7668E+02 0.5523E-01 0.7648E+02 0.6136E-01 0.7626E+02 0.6750E-01 0.7602E+02 0.7364E-01 0.7575E+02 0.7977E-01 0.7546E+02 0.8591E-01 0.7515E+02 0.9205E-01 0.7482E+02 0.9818E-01 0.7447E+02 0.1043E+00 0.7410E+02 0.1105E+00 0.7370E+02 0.1166E+00 0.7329E+02 0.1227E+00 0.7286E+02 0.1289E+00 0.7241E+02 0.1350E+00 0.7194E+02 0.1411E+00 0.7145E+02 0.1473E+00 0.7094E+02 0.1534E+00 0.7042E+02 0.1595E+00 0.6988E+02 0.1657E+00 0.6932E+02 0.1718E+00 0.6943E+02 0.1743E+01 0.6875E+02 0.6875E+02 0.1773E+00 0.6896E+02 0.1612E+01 0.6823E+02 0.6823E+02 0.1828E+00 0.6826E+02 0.1475E+01 0.6769E+02 0.6769E+02 0.1883E+00 0.6818E+02 0.1373E+01 0.6715E+02 0.6715E+02 0.1937E+00 0.6524E+02 0.1271E+01 0.6659E+02 0.6659E+02 0.1992E+00 0.6617E+02 0.1203E+01 0.6602E+02 0.6602E+02 0.2047E+00 0.6684E+02 0.1105E+01 0.6545E+02 0.6545E+02 0.2102E+00 0.6500E+02 0.1064E+01 0.6486E+02 0.6486E+02 0.2157E+00 0.6509E+02 0.9972E+00 0.6427E+02 0.6427E+02 0.2211E+00 0.6479E+02 0.9631E+00 0.6366E+02 0.6366E+02 0.2266E+00 0.6290E+02 0.9133E+00 0.6305E+02 0.6305E+02 0.2321E+00 0.6350E+02 0.8790E+00 0.6243E+02 0.6243E+02 0.2376E+00 0.6100E+02 0.8377E+00 0.6180E+02 0.6180E+02 0.2431E+00 0.6052E+02 0.8132E+00 0.6117E+02 0.6117E+02 0.2485E+00 0.6142E+02 0.7887E+00 0.6052E+02 0.6052E+02 0.2540E+00 0.5948E+02 0.7784E+00 0.5988E+02 0.5988E+02 0.2595E+00 0.5922E+02 0.7538E+00 0.5922E+02 0.5922E+02 0.2650E+00 0.5925E+02 0.7305E+00 0.5856E+02 0.5856E+02 0.2705E+00 0.5863E+02 0.7111E+00 0.5790E+02 0.5790E+02 0.2759E+00 0.5701E+02 0.6969E+00 0.5723E+02 0.5723E+02 0.2814E+00 0.5591E+02 0.6900E+00 0.5656E+02 0.5656E+02 0.2869E+00 0.5681E+02 0.6820E+00 0.5589E+02 0.5589E+02 0.2924E+00 0.5560E+02 0.6635E+00 0.5521E+02 0.5521E+02 0.2979E+00 0.5458E+02 0.6463E+00 0.5453E+02 0.5453E+02 0.3034E+00 0.5398E+02 0.6363E+00 0.5384E+02 0.5384E+02 0.3088E+00 0.5317E+02 0.6227E+00 0.5316E+02 0.5316E+02 0.3143E+00 0.5232E+02 0.6152E+00 0.5247E+02 0.5247E+02 0.3198E+00 0.5151E+02 0.5948E+00 0.5178E+02 0.5178E+02 0.3253E+00 0.5135E+02 0.5961E+00 0.5109E+02 0.5109E+02 0.3308E+00 0.4995E+02 0.5828E+00 0.5041E+02 0.5041E+02 0.3362E+00 0.4907E+02 0.5857E+00 0.4972E+02 0.4972E+02 0.3417E+00 0.4893E+02 0.5695E+00 0.4903E+02 0.4903E+02 0.3472E+00 0.4808E+02 0.5717E+00 0.4834E+02 0.4834E+02 0.3527E+00 0.4703E+02 0.5656E+00 0.4765E+02 0.4765E+02 0.3582E+00 0.4741E+02 0.5555E+00 0.4697E+02 0.4697E+02 0.3636E+00 0.4583E+02 0.5558E+00 0.4629E+02 0.4629E+02 0.3691E+00 0.4550E+02 0.5432E+00 0.4560E+02 0.4560E+02 0.3746E+00 0.4589E+02 0.5449E+00 0.4492E+02 0.4492E+02 0.3801E+00 0.4458E+02 0.5398E+00 0.4425E+02 0.4425E+02 0.3856E+00 0.4391E+02 0.5374E+00 0.4358E+02 0.4358E+02 0.3910E+00 0.4206E+02 0.5264E+00 0.4291E+02 0.4291E+02 0.3965E+00 0.4240E+02 0.5259E+00 0.4224E+02 0.4224E+02 0.4020E+00 0.4178E+02 0.5181E+00 0.4158E+02 0.4158E+02 0.4075E+00 0.4084E+02 0.5200E+00 0.4092E+02 0.4092E+02 0.4130E+00 0.4015E+02 0.5082E+00 0.4027E+02 0.4027E+02 0.4184E+00 0.3980E+02 0.5135E+00 0.3962E+02 0.3962E+02 0.4239E+00 0.3868E+02 0.5025E+00 0.3897E+02 0.3897E+02 0.4294E+00 0.3773E+02 0.4947E+00 0.3833E+02 0.3833E+02 0.4349E+00 0.3773E+02 0.4926E+00 0.3770E+02 0.3770E+02 0.4404E+00 0.3654E+02 0.4924E+00 0.3707E+02 0.3707E+02 0.4458E+00 0.3641E+02 0.4812E+00 0.3645E+02 0.3645E+02 0.4513E+00 0.3593E+02 0.4829E+00 0.3584E+02 0.3584E+02 0.4568E+00 0.3479E+02 0.4768E+00 0.3523E+02 0.3523E+02 0.4623E+00 0.3439E+02 0.4705E+00 0.3462E+02 0.3462E+02 0.4678E+00 0.3375E+02 0.4708E+00 0.3402E+02 0.3402E+02 0.4733E+00 0.3415E+02 0.4718E+00 0.3343E+02 0.3343E+02 0.4787E+00 0.3353E+02 0.4637E+00 0.3285E+02 0.3285E+02 0.4842E+00 0.3272E+02 0.4682E+00 0.3227E+02 0.3227E+02 0.4897E+00 0.3277E+02 0.4638E+00 0.3170E+02 0.3170E+02 0.4952E+00 0.3194E+02 0.4525E+00 0.3114E+02 0.3114E+02 0.5007E+00 0.3027E+02 0.4529E+00 0.3058E+02 0.3058E+02 0.5061E+00 0.3040E+02 0.4498E+00 0.3003E+02 0.3003E+02 0.5116E+00 0.3007E+02 0.4526E+00 0.2949E+02 0.2949E+02 0.5171E+00 0.2839E+02 0.4443E+00 0.2896E+02 0.2896E+02 0.5226E+00 0.2893E+02 0.4453E+00 0.2843E+02 0.2843E+02 0.5281E+00 0.2814E+02 0.4410E+00 0.2791E+02 0.2791E+02 0.5335E+00 0.2776E+02 0.4373E+00 0.2740E+02 0.2740E+02 0.5390E+00 0.2723E+02 0.4387E+00 0.2690E+02 0.2690E+02 0.5445E+00 0.2682E+02 0.4338E+00 0.2640E+02 0.2640E+02 0.5500E+00 0.2587E+02 0.4317E+00 0.2591E+02 0.2591E+02 0.5555E+00 0.2606E+02 0.4304E+00 0.2543E+02 0.2543E+02 0.5609E+00 0.2496E+02 0.4249E+00 0.2496E+02 0.2496E+02 0.5664E+00 0.2500E+02 0.4223E+00 0.2449E+02 0.2449E+02 0.5719E+00 0.2417E+02 0.4213E+00 0.2403E+02 0.2403E+02 0.5774E+00 0.2385E+02 0.4151E+00 0.2358E+02 0.2358E+02 0.5829E+00 0.2349E+02 0.4136E+00 0.2314E+02 0.2314E+02 0.5883E+00 0.2287E+02 0.4142E+00 0.2271E+02 0.2271E+02 0.5938E+00 0.2165E+02 0.4170E+00 0.2228E+02 0.2228E+02 0.5993E+00 0.2234E+02 0.4085E+00 0.2186E+02 0.2186E+02 0.6048E+00 0.2107E+02 0.4035E+00 0.2144E+02 0.2144E+02 0.6103E+00 0.2133E+02 0.4022E+00 0.2104E+02 0.2104E+02 0.6157E+00 0.2107E+02 0.4019E+00 0.2064E+02 0.2064E+02 0.6212E+00 0.2057E+02 0.3980E+00 0.2025E+02 0.2025E+02 0.6267E+00 0.1962E+02 0.3985E+00 0.1986E+02 0.1986E+02 0.6322E+00 0.1974E+02 0.3889E+00 0.1949E+02 0.1949E+02 0.6377E+00 0.1944E+02 0.3942E+00 0.1912E+02 0.1912E+02 0.6432E+00 0.1847E+02 0.3873E+00 0.1876E+02 0.1876E+02 0.6486E+00 0.1855E+02 0.3858E+00 0.1840E+02 0.1840E+02 0.6541E+00 0.1893E+02 0.3855E+00 0.1805E+02 0.1805E+02 0.6596E+00 0.1782E+02 0.3828E+00 0.1771E+02 0.1771E+02 0.6651E+00 0.1727E+02 0.3820E+00 0.1737E+02 0.1737E+02 0.6706E+00 0.1729E+02 0.3777E+00 0.1704E+02 0.1704E+02 0.6760E+00 0.1745E+02 0.3795E+00 0.1672E+02 0.1672E+02 0.6815E+00 0.1701E+02 0.3769E+00 0.1640E+02 0.1640E+02 0.6870E+00 0.1622E+02 0.3774E+00 0.1609E+02 0.1609E+02 0.6925E+00 0.1588E+02 0.3722E+00 0.1579E+02 0.1579E+02 0.6980E+00 0.1568E+02 0.3722E+00 0.1549E+02 0.1549E+02 0.7034E+00 0.1559E+02 0.3663E+00 0.1519E+02 0.1519E+02 0.7089E+00 0.1557E+02 0.3682E+00 0.1491E+02 0.1491E+02 0.7144E+00 0.1399E+02 0.3610E+00 0.1463E+02 0.1463E+02 0.7199E+00 0.1416E+02 0.3690E+00 0.1435E+02 0.1435E+02 0.7254E+00 0.1441E+02 0.3661E+00 0.1408E+02 0.1408E+02 0.7308E+00 0.1303E+02 0.3574E+00 0.1382E+02 0.1382E+02 0.7363E+00 0.1411E+02 0.3576E+00 0.1356E+02 0.1356E+02 0.7418E+00 0.1289E+02 0.3525E+00 0.1330E+02 0.1330E+02 0.7473E+00 0.1314E+02 0.3527E+00 0.1305E+02 0.1305E+02 0.7528E+00 0.1314E+02 0.3541E+00 0.1281E+02 0.1281E+02 0.7582E+00 0.1253E+02 0.3527E+00 0.1257E+02 0.1257E+02 0.7637E+00 0.1292E+02 0.3541E+00 0.1233E+02 0.1233E+02 0.7692E+00 0.1195E+02 0.3498E+00 0.1210E+02 0.1210E+02 0.7747E+00 0.1203E+02 0.3456E+00 0.1188E+02 0.1188E+02 0.7802E+00 0.1118E+02 0.3419E+00 0.1166E+02 0.1166E+02 0.7856E+00 0.1160E+02 0.3405E+00 0.1144E+02 0.1144E+02 0.7911E+00 0.1117E+02 0.3471E+00 0.1123E+02 0.1123E+02 0.7966E+00 0.1164E+02 0.3408E+00 0.1102E+02 0.1102E+02 0.8021E+00 0.1092E+02 0.3426E+00 0.1081E+02 0.1081E+02 0.8076E+00 0.1085E+02 0.3382E+00 0.1061E+02 0.1061E+02 0.8131E+00 0.1060E+02 0.3399E+00 0.1042E+02 0.1042E+02 0.8185E+00 0.1007E+02 0.3382E+00 0.1022E+02 0.1022E+02 0.8240E+00 0.1004E+02 0.3468E+00 0.1004E+02 0.1004E+02 0.8295E+00 0.9829E+01 0.3437E+00 0.9850E+01 0.9850E+01 0.8350E+00 0.9447E+01 0.3393E+00 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0.2038E+01 0.1006E+01 0.2979E+00 0.5960E+00 0.5960E+00 0.2043E+01 -0.8783E-01 0.2973E+00 0.5920E+00 0.5920E+00 0.2049E+01 0.2574E+00 0.2971E+00 0.5881E+00 0.5881E+00 0.2054E+01 0.6122E+00 0.3003E+00 0.5842E+00 0.5842E+00 0.2060E+01 0.1147E+00 0.2988E+00 0.5803E+00 0.5803E+00 0.2065E+01 0.5625E+00 0.3006E+00 0.5764E+00 0.5764E+00 0.2071E+01 0.4868E+00 0.2991E+00 0.5726E+00 0.5726E+00 0.2076E+01 0.3618E+00 0.3014E+00 0.5688E+00 0.5688E+00 0.2082E+01 0.4940E+00 0.3005E+00 0.5650E+00 0.5650E+00 0.2087E+01 0.8392E+00 0.2996E+00 0.5613E+00 0.5613E+00 0.2093E+01 0.4838E+00 0.2978E+00 0.5575E+00 0.5575E+00 0.2098E+01 0.5555E+00 0.2994E+00 0.5538E+00 0.5538E+00 0.2104E+01 0.3078E+00 0.2969E+00 0.5502E+00 0.5502E+00 0.2109E+01 0.5834E+00 0.3013E+00 0.5466E+00 0.5466E+00 0.2115E+01 0.5274E+00 0.3002E+00 0.5430E+00 0.5430E+00 0.2120E+01 0.4211E+00 0.2982E+00 0.5395E+00 0.5395E+00 0.2126E+01 0.4793E+00 0.2986E+00 0.5360E+00 0.5360E+00 0.2131E+01 -0.2095E-01 0.3012E+00 0.5325E+00 0.5325E+00 0.2137E+01 0.8577E+00 0.2981E+00 0.5291E+00 0.5291E+00 0.2142E+01 0.2375E+00 0.2953E+00 0.5258E+00 0.5258E+00 0.2148E+01 0.1897E+00 0.2973E+00 0.5225E+00 0.5225E+00 0.2153E+01 0.4480E+00 0.2974E+00 0.5192E+00 0.5192E+00 0.2159E+01 0.6930E-01 0.2963E+00 0.5160E+00 0.5160E+00 0.2164E+01 0.2267E+00 0.2973E+00 0.5129E+00 0.5129E+00 0.2170E+01 0.4525E+00 0.2958E+00 0.5098E+00 0.5098E+00 0.2175E+01 0.2920E+00 0.2970E+00 0.5067E+00 0.5067E+00 0.2180E+01 0.7648E+00 0.2970E+00 0.5037E+00 0.5037E+00 0.2186E+01 0.1946E+00 0.2976E+00 0.5008E+00 0.5008E+00 0.2191E+01 0.5476E+00 0.2962E+00 0.4979E+00 0.4979E+00 0.2197E+01 0.5359E+00 0.2953E+00 0.4951E+00 0.4951E+00 0.2202E+01 0.4917E+00 0.2995E+00 0.4924E+00 0.4924E+00 0.2208E+01 0.4459E+00 0.2957E+00 0.4897E+00 0.4897E+00 0.2213E+01 0.5424E+00 0.2992E+00 0.4870E+00 0.4870E+00 0.2219E+01 -0.7021E-01 0.2905E+00 0.4844E+00 0.4844E+00 0.2224E+01 0.6217E+00 0.2947E+00 0.4819E+00 0.4819E+00 0.2230E+01 0.9628E+00 0.2960E+00 0.4795E+00 0.4795E+00 0.2235E+01 0.3670E+00 0.2929E+00 0.4771E+00 0.4771E+00 0.2241E+01 0.2885E+00 0.2964E+00 0.4748E+00 0.4748E+00 0.2246E+01 0.1607E+00 0.2969E+00 0.4725E+00 0.4725E+00 0.2252E+01 0.4986E+00 0.2952E+00 0.4703E+00 0.4703E+00 0.2257E+01 0.8391E+00 0.2949E+00 0.4681E+00 0.4681E+00 0.2263E+01 0.1026E+01 0.2979E+00 0.4660E+00 0.4660E+00 0.2268E+01 0.3204E+00 0.2964E+00 0.4640E+00 0.4640E+00 0.2274E+01 0.2908E+00 0.2938E+00 0.4620E+00 0.4620E+00 0.2279E+01 0.4612E+00 0.2975E+00 0.4601E+00 0.4601E+00 0.2285E+01 0.6846E+00 0.2955E+00 0.4582E+00 0.4582E+00 0.2290E+01 0.8606E+00 0.2928E+00 0.4564E+00 0.4564E+00 0.2296E+01 0.6679E+00 0.2986E+00 0.4547E+00 0.4547E+00 0.2301E+01 0.7178E-01 0.2954E+00 0.4530E+00 0.4530E+00 0.2307E+01 0.4748E+00 0.2959E+00 0.4514E+00 0.4514E+00 0.2312E+01 0.5342E+00 0.2952E+00 0.4498E+00 0.4498E+00 0.2317E+01 0.1223E+00 0.2928E+00 0.4482E+00 0.4482E+00 0.2323E+01 0.6362E+00 0.2943E+00 0.4467E+00 0.4467E+00 0.2328E+01 0.9421E+00 0.2942E+00 0.4453E+00 0.4453E+00 0.2334E+01 0.3324E+00 0.2922E+00 0.4439E+00 0.4439E+00 0.2339E+01 0.3080E+00 0.2934E+00 0.4425E+00 0.4425E+00 0.2345E+01 0.6093E+00 0.2944E+00 0.4412E+00 0.4412E+00 0.2350E+01 -0.3214E+00 0.2955E+00 0.4399E+00 0.4399E+00 0.2356E+01 0.2368E+00 0.2948E+00 0.4387E+00 0.4387E+00 0.2361E+01 0.5578E+00 0.2940E+00 0.4374E+00 0.4374E+00 0.2367E+01 0.6930E+00 0.2926E+00 0.4363E+00 0.4363E+00 0.2372E+01 0.2824E+00 0.2894E+00 0.4351E+00 0.4351E+00 0.2378E+01 0.2531E+00 0.2898E+00 0.4340E+00 0.4340E+00 0.2383E+01 0.3706E+00 0.2923E+00 0.4329E+00 0.4329E+00 0.2389E+01 0.3622E+00 0.2914E+00 0.4318E+00 0.4318E+00 0.2394E+01 0.4179E+00 0.2917E+00 0.4308E+00 0.4308E+00 0.2400E+01 0.3913E+00 0.2966E+00 0.4298E+00 0.4298E+00 0.2405E+01 0.3608E+00 0.2925E+00 0.4288E+00 0.4288E+00 0.2411E+01 0.1663E+00 0.2916E+00 0.4278E+00 0.4278E+00 0.2416E+01 0.4297E+00 0.2912E+00 0.4268E+00 0.4268E+00 0.2422E+01 0.2321E+00 0.2921E+00 0.4258E+00 0.4258E+00 0.2427E+01 0.4830E+00 0.2907E+00 0.4249E+00 0.4249E+00 0.2433E+01 0.8161E+00 0.2901E+00 0.4239E+00 0.4239E+00 0.2438E+01 -0.2417E+00 0.2881E+00 0.4230E+00 0.4230E+00 0.2444E+01 0.1940E+00 0.2895E+00 0.4221E+00 0.4221E+00 0.2449E+01 0.3550E+00 0.2895E+00 0.4211E+00 0.4211E+00 0.2454E+01 0.9486E+00 0.2949E+00 0.4202E+00 0.4202E+00 0.2460E+01 0.6301E+00 0.2910E+00 0.4193E+00 0.4193E+00 0.2465E+01 0.1729E+00 0.2925E+00 0.4183E+00 0.4183E+00 0.2471E+01 0.6175E+00 0.2927E+00 0.4174E+00 0.4174E+00 0.2476E+01 0.3932E+00 0.2898E+00 0.4165E+00 0.4165E+00 0.2482E+01 0.5624E+00 0.2942E+00 0.4155E+00 0.4155E+00 0.2487E+01 0.1740E+00 0.2902E+00 0.4146E+00 0.4146E+00 0.2493E+01 -0.7787E-02 0.2883E+00 0.4136E+00 0.4136E+00 0.2498E+01 0.4854E+00 0.2877E+00 0.4126E+00 0.4126E+00 0.2504E+01 0.5981E+00 0.2949E+00 0.4117E+00 0.4117E+00 0.2509E+01 -0.1484E+00 0.2895E+00 0.4107E+00 0.4107E+00 0.2515E+01 0.5132E+00 0.2946E+00 0.4097E+00 0.4097E+00 0.2520E+01 0.5333E+00 0.2907E+00 0.4086E+00 0.4086E+00 0.2526E+01 0.8410E+00 0.2916E+00 0.4076E+00 0.4076E+00 0.2531E+01 0.2962E-01 0.2899E+00 0.4066E+00 0.4066E+00 0.2537E+01 0.4738E+00 0.2911E+00 0.4055E+00 0.4055E+00 0.2542E+01 0.3719E+00 0.2861E+00 0.4045E+00 0.4045E+00 0.2548E+01 0.3587E+00 0.2896E+00 0.4033E+00 0.4033E+00 0.2553E+01 0.1738E+00 0.2874E+00 0.4022E+00 0.4022E+00 0.2559E+01 0.4208E+00 0.2878E+00 0.4011E+00 0.4011E+00 0.2564E+01 0.8827E+00 0.2888E+00 0.4000E+00 0.4000E+00 0.2570E+01 -0.5801E-01 0.2895E+00 0.3988E+00 0.3988E+00 0.2575E+01 0.6000E-01 0.2895E+00 0.3976E+00 0.3976E+00 0.2581E+01 0.3986E+00 0.2904E+00 0.3964E+00 0.3964E+00 0.2586E+01 0.4631E+00 0.3085E+00 0.3952E+00 0.3952E+00 0.2592E+01 0.6194E-01 0.3488E+00 0.3940E+00 0.3940E+00 0.2597E+01 0.2467E+00 0.3733E+00 0.3928E+00 0.3928E+00 0.2602E+01 0.9918E+00 0.4034E+00 0.3915E+00 0.3915E+00 0.2608E+01 0.4045E+00 0.4165E+00 0.3903E+00 0.3903E+00 0.2613E+01 0.3227E+00 0.4332E+00 0.3890E+00 0.3890E+00 0.2619E+01 0.6931E+00 0.4145E+00 0.3877E+00 0.3877E+00 0.2624E+01 0.1380E+00 0.3437E+00 0.3864E+00 0.3864E+00 0.2630E+01 0.2481E+00 0.3315E+00 0.3851E+00 0.3851E+00 0.2635E+01 0.4481E+00 0.3254E+00 0.3838E+00 0.3838E+00 0.2641E+01 0.5100E+00 0.3192E+00 0.3824E+00 0.3824E+00 0.2646E+01 0.7167E+00 0.3156E+00 0.3811E+00 0.3811E+00 0.2652E+01 0.8065E+00 0.3141E+00 0.3797E+00 0.3797E+00 0.2657E+01 0.5233E+00 0.3117E+00 0.3784E+00 0.3784E+00 0.2663E+01 0.5569E+00 0.3142E+00 0.3770E+00 0.3770E+00 0.2668E+01 0.3672E+00 0.3090E+00 0.3756E+00 0.3756E+00 0.2674E+01 0.2305E+00 0.3124E+00 0.3743E+00 0.3743E+00 0.2679E+01 0.4461E+00 0.3115E+00 0.3729E+00 0.3729E+00 0.2685E+01 0.3692E+00 0.3136E+00 0.3715E+00 0.3715E+00 0.2690E+01 0.6384E+00 0.3069E+00 0.3701E+00 0.3701E+00 0.2696E+01 0.1298E+00 0.3103E+00 0.3687E+00 0.3687E+00 0.2701E+01 0.3031E-01 0.3086E+00 0.3674E+00 0.3674E+00 0.2707E+01 0.7553E+00 0.3067E+00 0.3660E+00 0.3660E+00 0.2712E+01 0.5891E+00 0.3054E+00 0.3646E+00 0.3646E+00 0.2718E+01 0.6108E+00 0.3037E+00 0.3632E+00 0.3632E+00 0.2723E+01 0.5333E+00 0.3022E+00 0.3619E+00 0.3619E+00 0.2729E+01 0.9851E+00 0.2961E+00 0.3605E+00 0.3605E+00 0.2734E+01 0.4378E-01 0.2948E+00 0.3591E+00 0.3591E+00 0.2739E+01 0.2242E+00 0.2953E+00 0.3578E+00 0.3578E+00 0.2745E+01 0.5446E+00 0.2891E+00 0.3564E+00 0.3564E+00 0.2750E+01 0.6689E+00 0.2901E+00 0.3551E+00 0.3551E+00 0.2756E+01 0.8374E+00 0.2923E+00 0.3538E+00 0.3538E+00 0.2761E+01 0.5063E+00 0.2915E+00 0.3525E+00 0.3525E+00 0.2767E+01 0.5332E+00 0.2928E+00 0.3512E+00 0.3512E+00 0.2772E+01 0.3764E+00 0.2930E+00 0.3499E+00 0.3499E+00 0.2778E+01 0.6205E-01 0.2901E+00 0.3486E+00 0.3486E+00 0.2783E+01 -0.1056E+00 0.2889E+00 0.3473E+00 0.3473E+00 0.2789E+01 0.2674E+00 0.2935E+00 0.3460E+00 0.3460E+00 0.2794E+01 0.3564E+00 0.2941E+00 0.3448E+00 0.3448E+00 0.2800E+01 0.2050E+00 0.2906E+00 0.3436E+00 0.3436E+00 0.2805E+01 0.3627E+00 0.2871E+00 0.3423E+00 0.3423E+00 0.2811E+01 0.8646E+00 0.2909E+00 0.3411E+00 0.3411E+00 0.2816E+01 0.1357E+00 0.2873E+00 0.3399E+00 0.3399E+00 0.2822E+01 0.3131E+00 0.2943E+00 0.3388E+00 0.3388E+00 0.2827E+01 0.4407E+00 0.2920E+00 0.3376E+00 0.3376E+00 0.2833E+01 0.3243E+00 0.2868E+00 0.3364E+00 0.3364E+00 0.2838E+01 0.4430E+00 0.2899E+00 0.3353E+00 0.3353E+00 0.2844E+01 0.1022E+01 0.2913E+00 0.3342E+00 0.3342E+00 0.2849E+01 0.4787E+00 0.2907E+00 0.3331E+00 0.3331E+00 0.2855E+01 0.3441E+00 0.2916E+00 0.3320E+00 0.3320E+00 0.2860E+01 0.4336E+00 0.2900E+00 0.3309E+00 0.3309E+00 0.2866E+01 0.3678E+00 0.2853E+00 0.3298E+00 0.3298E+00 0.2871E+01 0.5522E-01 0.2890E+00 0.3287E+00 0.3287E+00 0.2877E+01 0.7360E+00 0.2919E+00 0.3277E+00 0.3277E+00 0.2882E+01 0.3368E+00 0.2863E+00 0.3267E+00 0.3267E+00 0.2887E+01 0.4764E+00 0.2905E+00 0.3256E+00 0.3256E+00 0.2893E+01 0.6015E+00 0.2879E+00 0.3246E+00 0.3246E+00 Distance distribution function of particle R P(R) ERROR 0.0000E+00 0.0000E+00 0.0000E+00 0.1157E+00 0.2753E-01 0.1427E-02 0.2314E+00 0.5917E-01 0.2280E-02 0.3471E+00 0.9485E-01 0.2616E-02 0.4628E+00 0.1345E+00 0.2525E-02 0.5785E+00 0.1779E+00 0.2146E-02 0.6942E+00 0.2249E+00 0.1702E-02 0.8099E+00 0.2752E+00 0.1567E-02 0.9256E+00 0.3284E+00 0.1957E-02 0.1041E+01 0.3843E+00 0.2604E-02 0.1157E+01 0.4422E+00 0.3235E-02 0.1273E+01 0.5015E+00 0.3717E-02 0.1388E+01 0.5618E+00 0.3994E-02 0.1504E+01 0.6223E+00 0.4060E-02 0.1620E+01 0.6822E+00 0.3950E-02 0.1736E+01 0.7409E+00 0.3738E-02 0.1851E+01 0.7976E+00 0.3530E-02 0.1967E+01 0.8517E+00 0.3436E-02 0.2083E+01 0.9024E+00 0.3518E-02 0.2198E+01 0.9493E+00 0.3754E-02 0.2314E+01 0.9918E+00 0.4057E-02 0.2430E+01 0.1030E+01 0.4337E-02 0.2545E+01 0.1063E+01 0.4529E-02 0.2661E+01 0.1090E+01 0.4606E-02 0.2777E+01 0.1113E+01 0.4576E-02 0.2893E+01 0.1131E+01 0.4478E-02 0.3008E+01 0.1144E+01 0.4370E-02 0.3124E+01 0.1152E+01 0.4316E-02 0.3240E+01 0.1157E+01 0.4362E-02 0.3355E+01 0.1157E+01 0.4512E-02 0.3471E+01 0.1154E+01 0.4735E-02 0.3587E+01 0.1148E+01 0.4982E-02 0.3702E+01 0.1139E+01 0.5209E-02 0.3818E+01 0.1127E+01 0.5385E-02 0.3934E+01 0.1113E+01 0.5502E-02 0.4050E+01 0.1098E+01 0.5566E-02 0.4165E+01 0.1080E+01 0.5596E-02 0.4281E+01 0.1061E+01 0.5612E-02 0.4397E+01 0.1040E+01 0.5627E-02 0.4512E+01 0.1018E+01 0.5646E-02 0.4628E+01 0.9940E+00 0.5662E-02 0.4744E+01 0.9690E+00 0.5662E-02 0.4859E+01 0.9429E+00 0.5636E-02 0.4975E+01 0.9158E+00 0.5576E-02 0.5091E+01 0.8878E+00 0.5487E-02 0.5207E+01 0.8592E+00 0.5383E-02 0.5322E+01 0.8301E+00 0.5285E-02 0.5438E+01 0.8008E+00 0.5211E-02 0.5554E+01 0.7715E+00 0.5175E-02 0.5669E+01 0.7424E+00 0.5180E-02 0.5785E+01 0.7137E+00 0.5215E-02 0.5901E+01 0.6857E+00 0.5267E-02 0.6016E+01 0.6584E+00 0.5321E-02 0.6132E+01 0.6321E+00 0.5370E-02 0.6248E+01 0.6067E+00 0.5415E-02 0.6364E+01 0.5823E+00 0.5466E-02 0.6479E+01 0.5588E+00 0.5535E-02 0.6595E+01 0.5364E+00 0.5636E-02 0.6711E+01 0.5148E+00 0.5773E-02 0.6826E+01 0.4939E+00 0.5946E-02 0.6942E+01 0.4738E+00 0.6145E-02 0.7058E+01 0.4542E+00 0.6359E-02 0.7173E+01 0.4351E+00 0.6576E-02 0.7289E+01 0.4163E+00 0.6790E-02 0.7405E+01 0.3979E+00 0.6999E-02 0.7521E+01 0.3798E+00 0.7205E-02 0.7636E+01 0.3620E+00 0.7411E-02 0.7752E+01 0.3444E+00 0.7618E-02 0.7868E+01 0.3272E+00 0.7826E-02 0.7983E+01 0.3103E+00 0.8028E-02 0.8099E+01 0.2938E+00 0.8214E-02 0.8215E+01 0.2778E+00 0.8374E-02 0.8330E+01 0.2622E+00 0.8495E-02 0.8446E+01 0.2472E+00 0.8571E-02 0.8562E+01 0.2328E+00 0.8596E-02 0.8678E+01 0.2191E+00 0.8571E-02 0.8793E+01 0.2059E+00 0.8501E-02 0.8909E+01 0.1933E+00 0.8394E-02 0.9025E+01 0.1814E+00 0.8260E-02 0.9140E+01 0.1700E+00 0.8111E-02 0.9256E+01 0.1592E+00 0.7957E-02 0.9372E+01 0.1489E+00 0.7809E-02 0.9487E+01 0.1391E+00 0.7676E-02 0.9603E+01 0.1298E+00 0.7564E-02 0.9719E+01 0.1208E+00 0.7476E-02 0.9835E+01 0.1123E+00 0.7412E-02 0.9950E+01 0.1042E+00 0.7367E-02 0.1007E+02 0.9635E-01 0.7334E-02 0.1018E+02 0.8886E-01 0.7299E-02 0.1030E+02 0.8165E-01 0.7246E-02 0.1041E+02 0.7466E-01 0.7157E-02 0.1053E+02 0.6785E-01 0.7013E-02 0.1064E+02 0.6114E-01 0.6791E-02 0.1076E+02 0.5445E-01 0.6473E-02 0.1088E+02 0.4770E-01 0.6039E-02 0.1099E+02 0.4079E-01 0.5470E-02 0.1111E+02 0.3360E-01 0.4747E-02 0.1122E+02 0.2603E-01 0.3854E-02 0.1134E+02 0.1798E-01 0.2774E-02 0.1145E+02 0.9330E-02 0.1494E-02 0.1157E+02 0.0000E+00 0.0000E+00 Reciprocal space: Rg = 3.48 , I(0) = 0.7743E+02 Real space: Rg = 3.49 +- 0.017 I(0) = 0.7744E+02 +- 0.3525E+00