-------------Start of calculation------------- initial values of parameters H1_298 -3.300e+04 S1_298 370.3 * H2_298 -1.751e+04 S2_298 163.6 H3_298 -1.415e+04 S3_298 112.4 H4_298 -6650. S4_298 200.4 value of L is -691.9 and of SS is 161.8 Process ended after 4 iterations Last ZXSSQ report ZXSSQ reports: convergence failed - the marquardt parameter exceeded parm(3) Gragient 2.787e-11 Function evaluations 78.00 Significant digits 10.00 Marquardt parameter 173.9 Number iterations 8.000 difL 9.890e-06, difv 0.01082 value of L is -659.6 and of SS is 163.1 Parameter +/- standard deviation H1_298 -2.624e+04 +- 2438. S1_298 375.7 +- 1.973 * H2_298 -1.751e+04 S2_298 166.0 +- 0.5039 H3_298 -1.506e+04 +- 1012. S3_298 111.5 +- 0.9529 H4_298 -6426. +- 3428. S4_298 200.5 +- 3.225 Correlation matrix - only for free parameters 1 0.9636 1 -0.1430 0.0004308 1 -0.05154 -0.05237 -0.02704 1 -0.08334 -0.04190 0.3191 0.8745 1 -0.006365 -0.007957 -0.01954 0.1432 0.1069 1 -0.01576 -0.003380 0.1112 0.1075 0.1986 0.8587 1 Results ID eq sr sga sgb A1 eq1, # 3.859 , # 1.920, # 0.006465; K1 eq1, # 3.859 , # 1.920, # 0.006465; C1a eq1, # 3.859 , # 1.920, # 0.006465; C1b eq1, # 3.859 , # 1.920, # 0.006465; A2 eq2, # 3.859 , # 1.920, # 0.006465; K2 eq2, # 3.859 , # 1.920, # 0.006465; A3 eq3, # 3.859 , # 1.920, # 0.006465; K3 eq3, # 3.859 , # 1.920, # 0.006465; K4 eq4, # 3.859 , # 1.920, # 0.006465; R4 eq4, # 3.859 0.9300, # 1.920, # 0.006465; R5 eq5, # 3.859 4.100, # 1.920, # 0.006465; R6 eq6, # 3.859 1.200, # 1.920, # 0.006465; R7 eq7, # 3.859 2.100, # 1.920, # 0.006465; Sc S, * 0.4000 , #1 6.174, n/a ; Sb S, * 0.4000 , #1 6.174, n/a ; Sa S, * 0.4000 , #1 6.174, n/a ; Hd H, * 1.000 , #2 0.000, n/a ; Hc H, * 1.000 , #2 0.000, n/a ; Hb1 H, * 1.000 , #2 0.000, n/a ; Hb2 H, * 1.000 , #2 0.000, n/a ; Ha H, * 1.000 , #2 0.000, n/a ; ID av_dev sri err_a err_b err1_b A1 21.54 6.364 -20.36 0.03195 3.034 K1 6.525 1.104 5.231 0.02918 3.742 C1a 1.957 1.457 0.8061 -0.03020 -1.028 C1b 4.128 4.047 0.2157 0.04119 0.7845 A2 8.733 7.059 4.016 0.03241 3.212 K2 9.036 1.518 -4.106 0.05267 7.906 A3 11.07 3.541 10.44 0.009405 0.9996 K3 3.383 0.8352 -3.246 -0.003764 -0.4631 K4 3.742 0.1476 -3.725 -0.003798 -0.3280 R4 3.480 0.8613 -3.359 -0.004601 -0.2853 R5 8.596 3.670 7.767 0.004942 0.3154 R6 3.966 1.083 -2.135 0.04954 3.162 R7 7.017 1.944 -6.739 -0.003176 -0.1970 Sc 3.932 0.000 3.932 n/a n/a Sb 1.353 0.000 1.353 n/a n/a Sa 1.219 0.000 1.219 n/a n/a Hd 0.9652 0.000 -0.9652 n/a n/a Hc 0.9999 0.000 -0.9999 n/a n/a Hb1 1.081 0.000 1.081 n/a n/a Hb2 0.1688 0.000 -0.1688 n/a n/a Ha 0.05606 0.000 -0.05606 n/a n/a ID Ntot Ns xav Ps A1 14 14 1096. 355.3 K1 9 9 1311. 384.7 C1a 18 18 1313. 144.5 C1b 20 20 1319. 85.17 A2 14 14 1100. 370.9 K2 9 9 1262. 450.3 A3 7 7 1065. 281.2 K3 9 9 1247. 369.1 K4 9 9 1206. 259.1 R4 14 14 1100. 232.1 R5 10 10 1100. 201.8 R6 10 10 1100. 201.8 R7 14 14 1100. 232.1 Sc 1 1 0.6667 0.000 Sb 1 1 0.5000 0.000 Sa 1 1 0.2500 0.000 Hd 1 1 0.8571 0.000 Hc 1 1 0.6667 0.000 Hb1 1 1 0.5000 0.000 Hb2 1 1 0.5000 0.000 Ha 1 1 0.2500 0.000 ****** post analysis ***** CA6 0.000 CA2 -5.090 CA -4.463 C3A -4.804