reference vector +0 +0 +1, all molecules around type 2, (Coulomb) energy integral INT(z*e^2*r*rho*g(r)/(2*epsilon0))dR
distance E(r)[J/mol]
   0.00000000       0.00000000    
   6.10016696E-02   0.00000000    
  0.122003339       0.00000000    
  0.183005005       0.00000000    
  0.244006678       0.00000000    
  0.305008352       0.00000000    
  0.366010010       0.00000000    
  0.427011698     -0.747232378    
  0.488013357      -3.50647116    
  0.549015045      -12.4344349    
  0.610016704      -36.0297508    
  0.671018362      -100.418137    
  0.732020020      -263.531677    
  0.793021679      -633.815918    
  0.854023397      -1387.76196    
  0.915025055      -2757.54932    
  0.976026714      -5111.25098    
   1.03702843      -8880.82227    
   1.09803009      -14527.4844    
   1.15903175      -22564.1719    
   1.22003341      -33332.2188    
   1.28103507      -46773.4336    
   1.34203672      -62787.2891    
   1.40303838      -81359.5156    
   1.46404004      -102379.234    
   1.52504170      -125578.914    
   1.58604336      -150462.281    
   1.64704514      -176221.031    
   1.70804679      -201900.797    
   1.76904845      -226755.047    
   1.83005011      -250158.156    
   1.89105177      -271768.594    
   1.95205343      -291409.688    
   2.01305509      -308985.500    
   2.07405686      -324511.156    
   2.13505840      -337919.031    
   2.19606018      -348684.156    
   2.25706172      -355750.094    
   2.31806350      -357648.688    
   2.37906504      -352922.750    
   2.44006681      -340925.219    
   2.50106835      -322313.188    
   2.56207013      -299403.312    
   2.62307191      -275312.125    
   2.68407345      -252957.906    
   2.74507523      -234695.469    
   2.80607677      -221746.219    
   2.86707854      -214286.734    
   2.92808008      -211719.062    
   2.98908186      -213178.812    
   3.05008340      -217835.531    
   3.11108518      -224780.031    
   3.17208672      -233381.219    
   3.23308849      -243143.406    
   3.29409027      -253533.047    
   3.35509181      -264154.406    
   3.41609359      -274770.031    
   3.47709513      -285098.406    
   3.53809690      -294845.281    
   3.59909844      -303849.156    
   3.66010022      -312004.656    
   3.72110176      -319213.938    
   3.78210354      -325377.469    
   3.84310508      -330501.469    
   3.90410686      -334656.062    
   3.96510863      -337889.969    
   4.02611017      -340323.594    
   4.08711195      -342116.844    
   4.14811373      -343414.875    
   4.20911503      -344357.812    
   4.27011681      -345058.812    
   4.33111858      -345611.594    
   4.39212036      -346077.312    
   4.45312166      -346495.156    
   4.51412344      -346895.719    
   4.57512522      -347308.594    
   4.63612700      -347763.594    
   4.69712877      -348284.281    
   4.75813007      -348869.375    
   4.81913185      -349534.406    
   4.88013363      -350303.125    
   4.94113541      -351178.562    
   5.00213671      -352163.156    
   5.06313848      -353258.531    
   5.12414026      -354481.250    
   5.18514204      -355828.281    
   5.24614382      -357288.344    
   5.30714512      -358878.000    
   5.36814690      -360578.188    
   5.42914867      -362373.844    
   5.49015045      -364253.844    
   5.55115175      -366190.719    
   5.61215353      -368188.969    
   5.67315531      -370236.500    
   5.73415709      -372294.688    
   5.79515839      -374312.125    
   5.85616016      -376274.531    
   5.91716194      -378174.312    
   5.97816372      -379969.750    
   6.03916550      -381645.250    
   6.10016680      -383180.781    
   6.16116858      -384520.812    
   6.22217035      -385629.375    
   6.28317213      -386539.875    
   6.34417343      -387237.250    
   6.40517521      -387669.125    
   6.46617699      -387858.562    
   6.52717876      -387839.250    
   6.58818054      -387622.500    
   6.64918184      -387213.500    
   6.71018362      -386643.094    
   6.77118540      -385935.969    
   6.83218718      -385104.625    
   6.89318848      -384149.719    
   6.95419025      -383132.438    
   7.01519203      -382115.906    
   7.07619381      -381065.812    
   7.13719511      -379986.719    
   7.19819689      -378917.625    
   7.25919867      -377854.625    
   7.32020044      -376815.656    
   7.38120222      -375798.031    
   7.44220352      -374755.438    
   7.50320530      -373726.750    
   7.56420708      -372773.375    
   7.62520885      -371849.906    
   7.68621016      -370951.906    
   7.74721193      -370122.156    
   7.80821371      -369338.062    
   7.86921549      -368593.125    
   7.93021727      -367892.562    
   7.99121857      -367208.500    
   8.05222034      -366530.844    
   8.11322212      -365927.969    
   8.17422390      -365361.250    
   8.23522568      -364836.812    
   8.29622746      -364367.969    
   8.35722828      -363935.562    
   8.41823006      -363529.469    
   8.47923183      -363129.844    
   8.54023361      -362805.906    
   8.60123539      -362561.781    
   8.66223717      -362381.906    
   8.72323895      -362214.688    
   8.78424072      -362070.219    
   8.84524250      -361962.094    
   8.90624332      -361879.031    
   8.96724510      -361809.375    
   9.02824688      -361750.625    
   9.08924866      -361731.719    
   9.15025043      -361736.781    
   9.21125221      -361758.219    
   9.27225399      -361794.531    
   9.33325577      -361839.312    
   9.39425755      -361888.594    
   9.45525837      -361935.938    
   9.51626015      -361960.969    
   9.57726192      -361989.875    
   9.63826370      -362016.906    
   9.69926548      -362045.844    
   9.76026726      -362037.594    
   9.82126904      -361975.000    
   9.88227081      -361932.812    
   9.94327259      -361895.750    
   10.0042734      -361815.188    
   10.0652752      -361708.188    
   10.1262770      -361595.406    
   10.1872787      -361454.156    
   10.2482805      -361295.031    
   10.3092823      -361091.375    
   10.3702841      -360871.312    
   10.4312859      -360671.938    
   10.4922876      -360472.406    
   10.5532885      -360313.531    
   10.6142902      -360106.250    
   10.6752920      -359816.875    
   10.7362938      -359521.375    
   10.7972956      -359255.719    
   10.8582973      -359015.594    
   10.9192991      -358778.406    
   10.9803009      -358534.750    
   11.0413017      -358307.406    
   11.1023035      -358085.719    
   11.1633053      -357845.938    
   11.2243071      -357586.188    
   11.2853088      -357322.562    
   11.3463106      -357069.719    
   11.4073124      -356830.969    
   11.4683142      -356623.469    
   11.5293159      -356404.875    
   11.5903168      -356229.844    
   11.6513186      -356097.531    
   11.7123203      -355974.125    
   11.7733221      -355855.875    
   11.8343239      -355737.594    
   11.8953257      -355647.562    
   11.9563274      -355571.469    
   12.0173292      -355502.094    
   12.0783310      -355470.656    
   12.1393318      -355476.531    
   12.2003336      -355496.438    
   12.2613354      -355531.375    
   12.3223372      -355606.312    
   12.3833389      -355726.719    
   12.4443407      -355802.375    
   12.5053425      -355873.031    
   12.5663443      -356031.656    
   12.6273460      -356206.531    
   12.6883469      -356384.594    
   12.7493486      -356571.500    
   12.8103504      -356806.281    
   12.8713522      -357084.406    
   12.9323540      -357313.844    
   12.9933558      -357542.469    
   13.0543575      -357807.844    
   13.1153593      -358075.031    
   13.1763611      -358345.969    
   13.2373619      -358614.000    
   13.2983637      -358866.406    
   13.3593655      -359109.500    
   13.4203672      -359342.062    
   13.4813690      -359590.750    
   13.5423708      -359856.469    
   13.6033726      -360120.062    
   13.6643744      -360357.094    
   13.7253761      -360534.469    
   13.7863770      -360676.969    
   13.8473787      -360806.125    
   13.9083805      -360911.469    
   13.9693823      -361010.719    
   14.0303841      -361121.375    
   14.0913858      -361231.156    
   14.1523876      -361329.500    
   14.2133894      -361411.062    
   14.2743902      -361485.062    
   14.3353920      -361507.219    
   14.3963938      -361458.219    
   14.4573956      -361409.781    
   14.5183973      -361372.938    
   14.5793991      -361318.500    
   14.6404009      -361266.906    
   14.7014027      -361209.594    
   14.7624044      -361146.750    
   14.8234053      -361076.344    
   14.8844070      -360967.531    
   14.9454088      -360839.688    
   15.0064106      -360717.062    
   15.0674124      -360586.781    
   15.1284142      -360448.688    
   15.1894159      -360354.406    
   15.2504177      -360254.812    
   15.3114195      -360127.938    
   15.3724203      -360030.469    
   15.4334221      -359929.000    
   15.4944239      -359817.219    
   15.5554256      -359705.594    
   15.6164274      -359586.844    
   15.6774292      -359471.062    
   15.7384310      -359372.156    
   15.7994328      -359266.656    
   15.8604345      -359144.062    
   15.9214354      -359030.938    
   15.9824371      -358957.844    
   16.0434399      -358917.188    
   16.1044407      -358868.781    
   16.1654415      -358834.594    
   16.2264442      -358834.844    
   16.2874451      -358831.625    
   16.3484478      -358829.281    
   16.4094486      -358858.312    
   16.4704514      -358866.719    
   16.5314522      -358867.844    
   16.5924549      -358913.844    
   16.6534557      -358948.438    
   16.7144566      -358951.625    
   16.7754593      -358994.781    
   16.8364601      -359068.625    
   16.8974628      -359124.594    
   16.9584637      -359175.781    
   17.0194664      -359241.500    
   17.0804672      -359312.312    
   17.1414700      -359376.812    
   17.2024708      -359432.188    
   17.2634716      -359495.812    
   17.3244743      -359584.219    
   17.3854752      -359692.156    
   17.4464779      -359821.281    
   17.5074787      -359933.000    
   17.5684814      -360027.844    
   17.6294823      -360110.375    
   17.6904850      -360194.781    
   17.7514858      -360290.344    
   17.8124866      -360384.906    
   17.8734894      -360500.156    
   17.9344902      -360625.375    
   17.9954929      -360749.562    
   18.0564938      -360855.719    
   18.1174965      -360962.031    
   18.1784973      -361071.969    
   18.2395000      -361180.719    
   18.3005009      -361277.250    
