==> F-ISAPT: Links by Charge <== => Full Analysis <= Frag1 Frag2 Elst Exch IndAB IndBA Disp Total Cl1 Cl1 0.423 0.624 -0.009 -0.009 -0.378 0.650 Cl1 O 0.739 1.311 -0.287 -0.014 -0.457 1.292 Cl1 Ph -1.683 0.016 0.185 0.006 -0.225 -1.701 Cl1 Link-1 0.141 -0.006 0.036 0.001 -0.049 0.122 Cl1 Link-2 -0.059 0.004 -0.033 -0.007 -0.063 -0.157 Cl1 Link-3 0.874 0.073 -0.112 0.021 -0.226 0.630 O Cl1 0.739 1.311 -0.014 -0.287 -0.457 1.292 O O 0.111 0.002 0.000 0.000 -0.009 0.104 O Ph -1.805 0.023 -0.035 -0.051 -0.073 -1.940 O Link-1 0.139 0.000 0.003 0.000 -0.001 0.141 O Link-2 -1.668 0.210 -0.043 -0.088 -0.105 -1.694 O Link-3 -0.004 0.000 -0.001 0.001 -0.005 -0.009 Ph Cl1 -1.683 0.016 0.006 0.185 -0.225 -1.701 Ph O -1.805 0.023 -0.051 -0.035 -0.073 -1.940 Ph Ph 3.482 0.000 0.026 0.026 -0.185 3.350 Ph Link-1 -0.180 -0.001 0.002 -0.005 -0.011 -0.195 Ph Link-2 0.899 0.000 -0.011 0.065 -0.058 0.894 Ph Link-3 -1.115 0.002 -0.030 -0.032 -0.055 -1.230 Link-1 Cl1 0.141 -0.006 0.001 0.036 -0.049 0.122 Link-1 O 0.139 0.000 0.000 0.003 -0.001 0.141 Link-1 Ph -0.180 -0.001 -0.005 0.002 -0.011 -0.195 Link-1 Link-1 0.017 0.000 0.000 0.000 -0.000 0.017 Link-1 Link-2 0.225 -0.008 -0.005 0.010 -0.012 0.210 Link-1 Link-3 0.105 0.000 -0.000 0.003 -0.001 0.107 Link-2 Cl1 -0.059 0.004 -0.007 -0.033 -0.063 -0.157 Link-2 O -1.668 0.210 -0.088 -0.043 -0.105 -1.694 Link-2 Ph 0.899 0.000 0.065 -0.011 -0.058 0.894 Link-2 Link-1 0.225 -0.008 0.010 -0.005 -0.012 0.210 Link-2 Link-2 -0.180 -0.000 -0.007 -0.007 -0.010 -0.204 Link-2 Link-3 -0.524 0.004 -0.036 -0.022 -0.058 -0.635 Link-3 Cl1 0.874 0.073 0.021 -0.112 -0.226 0.630 Link-3 O -0.004 0.000 0.001 -0.001 -0.005 -0.009 Link-3 Ph -1.115 0.002 -0.032 -0.030 -0.055 -1.230 Link-3 Link-1 0.105 0.000 0.003 -0.000 -0.001 0.107 Link-3 Link-2 -0.524 0.004 -0.022 -0.036 -0.058 -0.635 Link-3 Link-3 0.037 0.000 0.000 0.000 -0.002 0.035 Cl1 All 0.435 2.022 -0.220 -0.003 -1.398 0.836 O All -2.487 1.546 -0.090 -0.425 -0.650 -2.105 Ph All -0.402 0.040 -0.058 0.204 -0.607 -0.822 Link-1 All 0.446 -0.015 -0.008 0.054 -0.074 0.402 Link-2 All -1.308 0.211 -0.062 -0.120 -0.307 -1.586 Link-3 All -0.626 0.079 -0.030 -0.178 -0.347 -1.102 All Cl1 0.435 2.022 -0.003 -0.220 -1.398 0.836 All O -2.487 1.546 -0.425 -0.090 -0.650 -2.105 All Ph -0.402 0.040 0.204 -0.058 -0.607 -0.822 All Link-1 0.446 -0.015 0.054 -0.008 -0.074 0.402 All Link-2 -1.308 0.211 -0.120 -0.062 -0.307 -1.586 All Link-3 -0.626 0.079 -0.178 -0.030 -0.347 -1.102 All All -3.942 3.884 -0.468 -0.468 -3.382 -4.377 => Reduced Analysis <= Frag1 Frag2 Elst Exch IndAB IndBA Disp Total Cl1 Cl1 0.309 0.629 -0.032 -0.032 -0.447 0.426 Cl1 O 0.422 1.469 -0.399 -0.032 -0.724 0.735 Cl1 Ph -0.991 0.037 0.178 -0.003 -0.389 -1.167 O Cl1 0.422 1.469 -0.032 -0.399 -0.724 0.735 O O 0.385 0.002 0.003 0.003 -0.019 0.374 O Ph -3.458 0.122 -0.087 -0.119 -0.192 -3.735 Ph Cl1 -0.991 0.037 -0.003 0.178 -0.389 -1.167 Ph O -3.458 0.122 -0.119 -0.087 -0.192 -3.735 Ph Ph 3.419 -0.001 0.023 0.023 -0.305 3.159 Cl1 All -0.260 2.134 -0.253 -0.067 -1.561 -0.007 O All -2.652 1.592 -0.115 -0.516 -0.935 -2.626 Ph All -1.030 0.158 -0.099 0.114 -0.886 -1.744 All Cl1 -0.260 2.134 -0.067 -0.253 -1.561 -0.007 All O -2.652 1.592 -0.516 -0.115 -0.935 -2.626 All Ph -1.030 0.158 0.114 -0.099 -0.886 -1.744 All All -3.942 3.884 -0.468 -0.468 -3.382 -4.377 ==> F-ISAPT: Links 50-50 <== => Full Analysis <= Frag1 Frag2 Elst Exch IndAB IndBA Disp Total Cl1 Cl1 0.423 0.624 -0.009 -0.009 -0.378 0.650 Cl1 O 0.739 1.311 -0.287 -0.014 -0.457 1.292 Cl1 Ph -1.683 0.016 0.185 0.006 -0.225 -1.701 Cl1 Link-1 0.141 -0.006 0.036 0.001 -0.049 0.122 Cl1 Link-2 -0.059 0.004 -0.033 -0.007 -0.063 -0.157 Cl1 Link-3 0.874 0.073 -0.112 0.021 -0.226 0.630 O Cl1 0.739 1.311 -0.014 -0.287 -0.457 1.292 O O 0.111 0.002 0.000 0.000 -0.009 0.104 O Ph -1.805 0.023 -0.035 -0.051 -0.073 -1.940 O Link-1 0.139 0.000 0.003 0.000 -0.001 0.141 O Link-2 -1.668 0.210 -0.043 -0.088 -0.105 -1.694 O Link-3 -0.004 0.000 -0.001 0.001 -0.005 -0.009 Ph Cl1 -1.683 0.016 0.006 0.185 -0.225 -1.701 Ph O -1.805 0.023 -0.051 -0.035 -0.073 -1.940 Ph Ph 3.482 0.000 0.026 0.026 -0.185 3.350 Ph Link-1 -0.180 -0.001 0.002 -0.005 -0.011 -0.195 Ph Link-2 0.899 0.000 -0.011 0.065 -0.058 0.894 Ph Link-3 -1.115 0.002 -0.030 -0.032 -0.055 -1.230 Link-1 Cl1 0.141 -0.006 0.001 0.036 -0.049 0.122 Link-1 O 0.139 0.000 0.000 0.003 -0.001 0.141 Link-1 Ph -0.180 -0.001 -0.005 0.002 -0.011 -0.195 Link-1 Link-1 0.017 0.000 0.000 0.000 -0.000 0.017 Link-1 Link-2 0.225 -0.008 -0.005 0.010 -0.012 0.210 Link-1 Link-3 0.105 0.000 -0.000 0.003 -0.001 0.107 Link-2 Cl1 -0.059 0.004 -0.007 -0.033 -0.063 -0.157 Link-2 O -1.668 0.210 -0.088 -0.043 -0.105 -1.694 Link-2 Ph 0.899 0.000 0.065 -0.011 -0.058 0.894 Link-2 Link-1 0.225 -0.008 0.010 -0.005 -0.012 0.210 Link-2 Link-2 -0.180 -0.000 -0.007 -0.007 -0.010 -0.204 Link-2 Link-3 -0.524 0.004 -0.036 -0.022 -0.058 -0.635 Link-3 Cl1 0.874 0.073 0.021 -0.112 -0.226 0.630 Link-3 O -0.004 0.000 0.001 -0.001 -0.005 -0.009 Link-3 Ph -1.115 0.002 -0.032 -0.030 -0.055 -1.230 Link-3 Link-1 0.105 0.000 0.003 -0.000 -0.001 0.107 Link-3 Link-2 -0.524 0.004 -0.022 -0.036 -0.058 -0.635 Link-3 Link-3 0.037 0.000 0.000 0.000 -0.002 0.035 Cl1 All 0.435 2.022 -0.220 -0.003 -1.398 0.836 O All -2.487 1.546 -0.090 -0.425 -0.650 -2.105 Ph All -0.402 0.040 -0.058 0.204 -0.607 -0.822 Link-1 All 0.446 -0.015 -0.008 0.054 -0.074 0.402 Link-2 All -1.308 0.211 -0.062 -0.120 -0.307 -1.586 Link-3 All -0.626 0.079 -0.030 -0.178 -0.347 -1.102 All Cl1 0.435 2.022 -0.003 -0.220 -1.398 0.836 All O -2.487 1.546 -0.425 -0.090 -0.650 -2.105 All Ph -0.402 0.040 0.204 -0.058 -0.607 -0.822 All Link-1 0.446 -0.015 0.054 -0.008 -0.074 0.402 All Link-2 -1.308 0.211 -0.120 -0.062 -0.307 -1.586 All Link-3 -0.626 0.079 -0.178 -0.030 -0.347 -1.102 All All -3.942 3.884 -0.468 -0.468 -3.382 -4.377 => Reduced Analysis <= Frag1 Frag2 Elst Exch IndAB IndBA Disp Total Cl1 Cl1 0.319 0.628 -0.031 -0.031 -0.443 0.443 Cl1 O 0.338 1.449 -0.375 -0.032 -0.665 0.715 Cl1 Ph -0.875 0.051 0.155 -0.001 -0.443 -1.114 O Cl1 0.338 1.449 -0.032 -0.375 -0.665 0.715 O O 0.312 0.002 0.002 0.002 -0.016 0.303 O Ph -3.227 0.128 -0.080 -0.114 -0.180 -3.473 Ph Cl1 -0.875 0.051 -0.001 0.155 -0.443 -1.114 Ph O -3.227 0.128 -0.114 -0.080 -0.180 -3.473 Ph Ph 2.957 -0.001 0.007 0.007 -0.347 2.622 Cl1 All -0.219 2.128 -0.251 -0.063 -1.551 0.044 O All -2.577 1.578 -0.109 -0.487 -0.861 -2.455 Ph All -1.146 0.178 -0.108 0.082 -0.970 -1.965 All Cl1 -0.219 2.128 -0.063 -0.251 -1.551 0.044 All O -2.577 1.578 -0.487 -0.109 -0.861 -2.455 All Ph -1.146 0.178 0.082 -0.108 -0.970 -1.965 All All -3.942 3.884 -0.468 -0.468 -3.382 -4.377