reference vector +0 +0 +1, all molecules around type 1, (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     -0.747232437    
  0.488013357      -3.50647044    
  0.549015045      -12.4344158    
  0.610016704      -36.0298080    
  0.671018362      -100.418137    
  0.732020020      -263.532043    
  0.793021679      -633.816528    
  0.854023397      -1387.76245    
  0.915025055      -2757.55200    
  0.976026714      -5111.24365    
   1.03702843      -8880.80078    
   1.09803009      -14527.4648    
   1.15903175      -22564.1562    
   1.22003341      -33332.1953    
   1.28103507      -46773.4023    
   1.34203672      -62787.2344    
   1.40303838      -81359.4375    
   1.46404004      -102379.141    
   1.52504170      -125578.820    
   1.58604336      -150462.234    
   1.64704514      -176220.938    
   1.70804679      -201900.594    
   1.76904845      -226754.938    
   1.83005011      -250158.094    
   1.89105177      -271769.438    
   1.95205343      -291416.750    
   2.01305509      -309032.219    
   2.07405686      -324737.812    
   2.13505840      -338760.281    
   2.19606018      -351289.969    
   2.25706172      -362551.406    
   2.31806350      -372801.062    
   2.37906504      -382273.656    
   2.44006681      -391182.562    
   2.50106835      -399715.562    
   2.56207013      -408103.781    
   2.62307191      -416519.281    
   2.68407345      -425094.812    
   2.74507523      -433884.500    
   2.80607677      -442936.812    
   2.86707854      -452306.031    
   2.92808008      -461990.250    
   2.98908186      -472003.094    
   3.05008340      -482309.969    
   3.11108518      -492838.406    
   3.17208672      -503542.188    
   3.23308849      -514296.312    
   3.29409027      -524940.875    
   3.35509181      -535258.938    
   3.41609359      -545092.312    
   3.47709513      -554239.938    
   3.53809690      -562419.562    
   3.59909844      -569508.000    
   3.66010022      -575382.938    
   3.72110176      -579915.000    
   3.78210354      -583007.812    
   3.84310508      -584639.688    
   3.90410686      -584824.188    
   3.96510863      -583596.625    
   4.02611017      -581076.438    
   4.08711195      -577462.125    
   4.14811373      -572924.250    
   4.20911503      -567630.500    
   4.27011681      -561787.438    
   4.33111858      -555562.188    
   4.39212036      -549077.500    
   4.45312166      -542447.062    
   4.51412344      -535847.812    
   4.57512522      -529391.688    
   4.63612700      -523117.219    
   4.69712877      -517101.000    
   4.75813007      -511396.344    
   4.81913185      -506023.594    
   4.88013363      -501036.781    
   4.94113541      -496456.531    
   5.00213671      -492249.750    
   5.06313848      -488407.312    
   5.12414026      -484915.969    
   5.18514204      -481740.281    
   5.24614382      -478851.250    
   5.30714512      -476228.000    
   5.36814690      -473872.781    
   5.42914867      -471717.562    
   5.49015045      -469714.406    
   5.55115175      -467870.250    
   5.61215353      -466157.969    
   5.67315531      -464557.719    
   5.73415709      -463049.688    
   5.79515839      -461602.438    
   5.85616016      -460183.344    
   5.91716194      -458816.906    
   5.97816372      -457518.875    
   6.03916550      -456260.188    
   6.10016680      -455026.750    
   6.16116858      -453813.844    
   6.22217035      -452638.281    
   6.28317213      -451520.094    
   6.34417343      -450440.250    
   6.40517521      -449379.844    
   6.46617699      -448355.000    
   6.52717876      -447388.156    
   6.58818054      -446487.250    
   6.64918184      -445647.812    
   6.71018362      -444882.938    
   6.77118540      -444182.156    
   6.83218718      -443511.219    
   6.89318848      -442865.500    
   6.95419025      -442276.281    
   7.01519203      -441759.062    
   7.07619381      -441303.344    
   7.13719511      -440886.625    
   7.19819689      -440536.281    
   7.25919867      -440252.875    
   7.32020044      -440004.188    
   7.38120222      -439818.625    
   7.44220352      -439699.875    
   7.50320530      -439641.812    
   7.56420708      -439670.688    
   7.62520885      -439759.656    
   7.68621016      -439899.906    
   7.74721193      -440134.125    
   7.80821371      -440455.000    
   7.86921549      -440843.188    
   7.93021727      -441264.250    
   7.99121857      -441759.812    
   8.05222034      -442342.156    
   8.11322212      -442976.969    
   8.17422390      -443677.844    
   8.23522568      -444436.469    
   8.29622746      -445228.062    
   8.35722828      -446058.875    
   8.41823006      -446946.562    
   8.47923183      -447861.594    
   8.54023361      -448810.875    
   8.60123539      -449791.344    
   8.66223717      -450811.281    
   8.72323895      -451855.594    
   8.78424072      -452905.969    
   8.84524250      -453944.031    
   8.90624332      -454982.250    
   8.96724510      -456002.344    
   9.02824688      -456965.031    
   9.08924866      -457909.031    
   9.15025043      -458828.375    
   9.21125221      -459686.688    
   9.27225399      -460500.188    
   9.33325577      -461320.375    
   9.39425755      -462111.719    
   9.45525837      -462834.531    
   9.51626015      -463521.500    
   9.57726192      -464172.844    
   9.63826370      -464783.625    
   9.69926548      -465368.062    
   9.76026726      -465856.188    
   9.82126904      -466285.719    
   9.88227081      -466718.156    
   9.94327259      -467118.062    
   10.0042734      -467439.875    
   10.0652752      -467681.250    
   10.1262770      -467903.969    
   10.1872787      -468085.969    
   10.2482805      -468198.125    
   10.3092823      -468247.281    
   10.3702841      -468241.469    
   10.4312859      -468225.062    
   10.4922876      -468209.062    
   10.5532885      -468180.312    
   10.6142902      -468102.688    
   10.6752920      -467971.906    
   10.7362938      -467813.312    
   10.7972956      -467656.375    
   10.8582973      -467484.688    
   10.9192991      -467281.438    
   10.9803009      -467037.094    
   11.0413017      -466769.688    
   11.1023035      -466486.125    
   11.1633053      -466176.500    
   11.2243071      -465876.688    
   11.2853088      -465593.719    
   11.3463106      -465288.969    
   11.4073124      -464936.688    
   11.4683142      -464588.406    
   11.5293159      -464244.531    
   11.5903168      -463932.188    
   11.6513186      -463629.625    
   11.7123203      -463308.531    
   11.7733221      -463055.281    
   11.8343239      -462802.344    
   11.8953257      -462541.594    
   11.9563274      -462356.188    
   12.0173292      -462164.156    
   12.0783310      -461960.188    
   12.1393318      -461799.812    
   12.2003336      -461674.094    
   12.2613354      -461549.812    
   12.3223372      -461417.469    
   12.3833389      -461318.250    
   12.4443407      -461219.750    
   12.5053425      -461166.375    
   12.5663443      -461166.344    
   12.6273460      -461163.875    
   12.6883469      -461187.906    
   12.7493486      -461216.188    
   12.8103504      -461269.562    
   12.8713522      -461351.750    
   12.9323540      -461443.250    
   12.9933558      -461559.375    
   13.0543575      -461705.594    
   13.1153593      -461861.094    
   13.1763611      -462038.156    
   13.2373619      -462233.562    
   13.2983637      -462410.250    
   13.3593655      -462613.438    
   13.4203672      -462844.344    
   13.4813690      -463062.344    
   13.5423708      -463282.125    
   13.6033726      -463472.875    
   13.6643744      -463661.688    
   13.7253761      -463851.781    
   13.7863770      -464018.594    
   13.8473787      -464176.875    
   13.9083805      -464329.938    
   13.9693823      -464485.938    
   14.0303841      -464626.156    
   14.0913858      -464730.719    
   14.1523876      -464809.781    
   14.2133894      -464890.844    
   14.2743902      -464968.219    
   14.3353920      -465037.594    
   14.3963938      -465087.719    
   14.4573956      -465110.438    
   14.5183973      -465095.562    
   14.5793991      -465079.562    
   14.6404009      -465071.531    
   14.7014027      -465024.781    
   14.7624044      -464968.875    
   14.8234053      -464913.000    
   14.8844070      -464809.750    
   14.9454088      -464687.375    
   15.0064106      -464575.281    
   15.0674124      -464469.344    
   15.1284142      -464353.562    
   15.1894159      -464217.969    
   15.2504177      -464072.312    
   15.3114195      -463907.812    
   15.3724203      -463770.844    
   15.4334221      -463633.719    
   15.4944239      -463468.969    
   15.5554256      -463281.531    
   15.6164274      -463098.156    
   15.6774292      -462946.281    
   15.7384310      -462792.219    
   15.7994328      -462629.750    
   15.8604345      -462435.219    
   15.9214354      -462235.656    
   15.9824371      -462107.250    
   16.0434399      -462039.781    
   16.1044407      -461936.594    
   16.1654415      -461831.469    
   16.2264442      -461768.156    
   16.2874451      -461702.875    
   16.3484478      -461625.781    
   16.4094486      -461578.062    
   16.4704514      -461526.969    
   16.5314522      -461469.562    
   16.5924549      -461435.000    
   16.6534557      -461369.500    
   16.7144566      -461304.500    
   16.7754593      -461252.594    
   16.8364601      -461222.844    
   16.8974628      -461211.688    
   16.9584637      -461185.250    
   17.0194664      -461173.125    
   17.0804672      -461178.062    
   17.1414700      -461162.219    
   17.2024708      -461131.969    
   17.2634716      -461095.469    
   17.3244743      -461075.250    
   17.3854752      -461106.719    
   17.4464779      -461153.812    
   17.5074787      -461171.688    
   17.5684814      -461179.531    
   17.6294823      -461180.656    
   17.6904850      -461224.969    
   17.7514858      -461312.531    
   17.8124866      -461358.469    
   17.8734894      -461398.000    
   17.9344902      -461446.062    
   17.9954929      -461495.875    
   18.0564938      -461552.219    
   18.1174965      -461587.875    
   18.1784973      -461603.938    
   18.2395000      -461637.094    
   18.3005009      -461702.250    
