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    
   6.07433319E-02   0.00000000    
  0.121486664       0.00000000    
  0.182229996       0.00000000    
  0.242973328       0.00000000    
  0.303716660       0.00000000    
  0.364459991       0.00000000    
  0.425203323     -0.750409126    
  0.485946655      -7.41244125    
  0.546689987      -30.5991096    
  0.607433319      -100.493896    
  0.668176651      -269.837524    
  0.728919983      -590.316772    
  0.789663315      -1123.23218    
  0.850406647      -1973.12402    
  0.911149979      -3240.45410    
  0.971893311      -5026.24756    
   1.03263664      -7493.99512    
   1.09337997      -10772.9502    
   1.15412331      -14999.1943    
   1.21486664      -20530.0977    
   1.27560997      -27631.2988    
   1.33635330      -36510.2500    
   1.39709663      -47494.3281    
   1.45783997      -60697.7773    
   1.51858330      -75923.8438    
   1.57932663      -92567.4688    
   1.64006996      -109902.633    
   1.70081329      -127219.773    
   1.76155663      -143924.500    
   1.82229996      -159794.625    
   1.88304329      -174685.203    
   1.94378662      -188508.656    
   2.00452995      -201342.141    
   2.06527328      -213190.812    
   2.12601662      -223786.203    
   2.18675995      -232458.391    
   2.24750328      -237881.375    
   2.30824661      -238234.016    
   2.36898994      -231890.078    
   2.42973328      -218423.594    
   2.49047661      -199266.094    
   2.55121994      -177114.266    
   2.61196327      -155441.641    
   2.67270660      -137143.562    
   2.73344994      -123554.680    
   2.79419327      -115014.703    
   2.85493660      -110997.703    
   2.91567993      -110573.719    
   2.97642326      -112944.188    
   3.03716660      -117282.742    
   3.09790993      -122896.938    
   3.15865326      -129358.984    
   3.21939659      -136255.984    
   3.28013992      -143320.781    
   3.34088326      -150478.312    
   3.40162659      -157641.641    
   3.46236992      -164704.359    
   3.52311325      -171561.234    
   3.58385658      -178145.812    
   3.64459991      -184403.516    
   3.70534325      -190290.500    
   3.76608658      -195838.469    
   3.82682991      -201059.031    
   3.88757324      -205962.953    
   3.94831657      -210541.406    
   4.00905991      -214809.875    
   4.06980324      -218785.062    
   4.13054657      -222461.281    
   4.19128990      -225844.953    
   4.25203323      -228944.469    
   4.31277657      -231736.266    
   4.37351990      -234234.859    
   4.43426323      -236464.484    
   4.49500656      -238423.531    
   4.55574989      -240148.484    
   4.61649323      -241688.094    
   4.67723656      -243091.844    
   4.73797989      -244379.188    
   4.79872322      -245562.391    
   4.85946655      -246692.297    
   4.92020988      -247817.484    
   4.98095322      -248936.406    
   5.04169655      -250051.672    
   5.10243988      -251190.781    
   5.16318321      -252356.953    
   5.22392654      -253541.875    
   5.28466988      -254772.375    
   5.34541321      -256054.672    
   5.40615654      -257371.344    
   5.46689987      -258717.266    
   5.52764320      -260093.875    
   5.58838654      -261498.906    
   5.64912987      -262911.969    
   5.70987320      -264333.094    
   5.77061653      -265738.250    
   5.83135986      -267101.656    
   5.89210320      -268397.500    
   5.95284653      -269601.906    
   6.01358986      -270719.000    
   6.07433319      -271748.594    
   6.13507652      -272668.656    
   6.19581985      -273451.406    
   6.25656319      -274121.906    
   6.31730652      -274697.219    
   6.37804985      -275201.531    
   6.43879318      -275621.750    
   6.49953651      -275943.469    
   6.56027985      -276195.375    
   6.62102318      -276381.812    
   6.68176651      -276518.906    
   6.74250984      -276623.875    
   6.80325317      -276711.656    
   6.86399651      -276784.188    
   6.92473984      -276833.125    
   6.98548317      -276859.562    
   7.04622650      -276895.938    
   7.10696983      -276967.125    
   7.16771317      -277069.688    
   7.22845650      -277193.969    
   7.28919983      -277335.344    
   7.34994316      -277504.969    
   7.41068649      -277689.406    
   7.47142982      -277850.438    
   7.53217316      -278028.938    
   7.59291649      -278220.812    
   7.65365982      -278398.000    
   7.71440315      -278587.281    
   7.77514648      -278786.062    
   7.83588982      -278972.312    
   7.89663315      -279149.031    
   7.95737648      -279344.031    
   8.01811981      -279512.656    
   8.07886314      -279685.094    
   8.13960648      -279884.625    
   8.20034981      -280066.219    
   8.26109314      -280198.125    
   8.32183647      -280294.531    
   8.38257980      -280410.188    
   8.44332314      -280520.625    
   8.50406647      -280613.656    
   8.56480980      -280708.281    
   8.62555313      -280816.469    
   8.68629646      -280886.094    
   8.74703979      -280865.094    
   8.80778313      -280812.969    
   8.86852646      -280751.781    
   8.92926979      -280735.250    
   8.99001312      -280743.406    
   9.05075645      -280712.125    
   9.11149979      -280699.656    
   9.17224312      -280673.875    
   9.23298645      -280648.031    
   9.29372978      -280631.875    
   9.35447311      -280607.250    
   9.41521645      -280594.719    
   9.47595978      -280594.125    
   9.53670311      -280600.906    
   9.59744644      -280569.281    
   9.65818977      -280524.719    
   9.71893311      -280496.531    
   9.77967644      -280417.500    
   9.84041977      -280285.312    
   9.90116310      -280172.125    
   9.96190643      -280069.469    
   10.0226498      -279906.812    
   10.0833931      -279685.906    
   10.1441364      -279444.156    
   10.2048798      -279190.781    
   10.2656231      -278960.000    
   10.3263664      -278719.438    
   10.3871098      -278440.188    
   10.4478531      -278151.156    
   10.5085964      -277876.438    
   10.5693398      -277596.375    
   10.6300831      -277287.594    
   10.6908264      -276959.375    
   10.7515697      -276618.094    
   10.8123131      -276265.438    
   10.8730564      -275866.281    
   10.9337997      -275429.844    
   10.9945431      -274985.562    
   11.0552864      -274552.719    
   11.1160297      -274140.750    
   11.1767731      -273711.250    
   11.2375164      -273244.000    
   11.2982597      -272774.438    
   11.3590031      -272345.062    
   11.4197464      -271956.969    
   11.4804897      -271554.344    
   11.5412331      -271123.438    
   11.6019764      -270676.625    
   11.6627197      -270283.719    
   11.7234631      -269932.312    
   11.7842064      -269582.875    
   11.8449497      -269261.375    
   11.9056931      -268968.938    
   11.9664364      -268700.469    
   12.0271797      -268439.844    
   12.0879230      -268228.344    
   12.1486664      -268087.875    
   12.2094097      -267984.656    
   12.2701530      -267878.094    
   12.3308964      -267849.781    
   12.3916397      -267831.125    
   12.4523830      -267769.750    
   12.5131264      -267779.062    
   12.5738697      -267866.531    
   12.6346130      -267995.531    
   12.6953564      -268121.562    
   12.7560997      -268308.938    
   12.8168430      -268526.406    
   12.8775864      -268725.500    
   12.9383297      -268933.062    
   12.9990730      -269137.844    
   13.0598164      -269341.188    
   13.1205597      -269590.906    
   13.1813030      -269861.469    
   13.2420464      -270092.781    
   13.3027897      -270345.844    
   13.3635330      -270626.312    
   13.4242764      -270947.219    
   13.4850197      -271278.844    
   13.5457630      -271583.281    
   13.6065063      -271890.000    
   13.6672497      -272182.312    
   13.7279930      -272438.812    
   13.7887363      -272656.344    
   13.8494797      -272888.875    
   13.9102230      -273141.562    
   13.9709663      -273352.750    
   14.0317097      -273524.094    
   14.0924530      -273691.625    
   14.1531963      -273855.188    
   14.2139397      -274014.094    
   14.2746830      -274141.250    
   14.3354263      -274201.062    
   14.3961697      -274247.500    
   14.4569130      -274306.375    
   14.5176563      -274369.406    
   14.5783997      -274427.781    
   14.6391430      -274461.812    
   14.6998863      -274448.719    
   14.7606297      -274429.969    
   14.8213730      -274421.500    
   14.8821163      -274421.906    
   14.9428596      -274414.375    
   15.0036030      -274383.906    
   15.0643463      -274314.844    
   15.1250896      -274214.875    
   15.1858330      -274131.000    
   15.2465763      -274018.094    
   15.3073196      -273923.500    
   15.3680630      -273843.719    
   15.4288063      -273756.812    
   15.4895496      -273679.812    
   15.5502930      -273611.250    
   15.6110363      -273521.562    
   15.6717796      -273380.062    
   15.7325230      -273253.562    
   15.7932663      -273156.438    
   15.8540096      -273027.156    
   15.9147530      -272906.562    
   15.9754963      -272778.750    
   16.0362396      -272653.719    
   16.0969830      -272596.812    
   16.1577263      -272554.219    
   16.2184696      -272465.031    
   16.2792130      -272395.000    
   16.3399563      -272374.125    
   16.4006996      -272340.750    
   16.4614429      -272342.219    
   16.5221863      -272349.656    
   16.5829296      -272322.781    
   16.6436729      -272298.875    
   16.7044163      -272284.219    
   16.7651596      -272271.156    
   16.8259029      -272252.250    
   16.8866463      -272251.594    
   16.9473896      -272276.938    
   17.0081329      -272274.812    
   17.0688763      -272289.375    
   17.1296196      -272360.719    
   17.1903629      -272414.875    
   17.2511063      -272448.844    
   17.3118496      -272527.219    
   17.3725929      -272618.188    
   17.4333363      -272719.812    
   17.4940796      -272864.625    
   17.5548229      -272981.625    
   17.6155663      -273052.344    
   17.6763096      -273129.375    
   17.7370529      -273215.062    
   17.7977962      -273319.312    
   17.8585396      -273438.375    
   17.9192829      -273576.250    
   17.9800262      -273684.594    
   18.0407696      -273739.125    
   18.1015129      -273832.875    
   18.1622562      -273962.094    
   18.2229996      -274085.531    
