No title                                
   1.00000000000000     
    11.0869000000000000    0.0000000000000000    0.0000000000000000
     5.5434500000000000    9.6015370499999992    0.0000000000000000
     0.0000000000000000    0.0000000000000000   29.0524009999999997
   Pt   H    O    S 
    64     2     3     1
Direct
  0.6657575799999975  0.6603301199999976  0.0034868899999978
  0.4156764100000032  0.9104592999999994  0.0034040500000003
  0.4158514200000027  0.6602686199999965  0.0036009600000000
  0.1659748399999970  0.9103370799999979  0.0035434699999968
  0.9164478699999989  0.4099760100000012  0.0031901700000034
  0.9160350200000025  0.1604623599999968  0.0034921600000004
  0.6656163000000035  0.4104838100000023  0.0035799099999991
  0.1655262499999992  0.1609449799999965  0.0030848000000034
  0.9158625999999970  0.9103071600000021  0.0035010799999995
  0.9159020100000035  0.6601455699999974  0.0034980599999983
  0.6657860299999996  0.9103284500000015  0.0035138900000007
  0.1660300300000017  0.6603227399999980  0.0035322199999968
  0.6657508199999995  0.1604991700000014  0.0035668700000002
  0.4159222199999988  0.4105027000000021  0.0036387299999987
  0.4155846600000004  0.1605041899999975  0.0035161099999996
  0.1656993400000033  0.4100122199999987  0.0033519099999992
  0.7491314099999968  0.7437023000000025  0.0825174200000021
  0.7495677499999971  0.4936500399999986  0.0822956199999965
  0.4988856200000029  0.7438773599999990  0.0828757199999970
  0.9992876399999986  0.4936508300000000  0.0824755800000005
  0.4992969799999969  0.9936191399999998  0.0824224500000028
  0.2494369599999970  0.2438961300000031  0.0825735499999993
  0.2491125499999995  0.9941517199999979  0.0823030299999985
  0.9994444200000032  0.2436983200000000  0.0824786200000034
  0.4991866399999978  0.4939854799999992  0.0833255100000017
  0.2499062400000014  0.7432857700000000  0.0830404800000011
  0.2492723499999983  0.4934796499999976  0.0824690700000019
  0.9994467799999995  0.7436668599999976  0.0824424099999987
  0.7487634800000009  0.2440482599999996  0.0825646199999994
  0.7492135899999965  0.9937616300000016  0.0825724800000032
  0.4991878399999976  0.2439837499999982  0.0827015099999997
  0.9993466000000026  0.9936265600000027  0.0824401899999998
  0.3334183999999993  0.3279810599999990  0.1605685199999982
  0.0832262099999994  0.5772977399999988  0.1600947199999965
  0.0831007199999974  0.3269863800000010  0.1600220300000004
  0.8323789800000014  0.5770282399999971  0.1601074299999965
  0.5828528500000019  0.0771050500000001  0.1601649099999989
  0.5828373000000013  0.8270922100000035  0.1602133000000023
  0.3329649900000007  0.0765833399999991  0.1600040800000002
  0.8330614099999991  0.8270679299999983  0.1601565400000027
  0.5805464199999975  0.5784413100000023  0.1615046399999969
  0.5824058800000032  0.3275284400000018  0.1608775999999992
  0.3340214999999986  0.5773888700000001  0.1616528500000030
  0.8320779000000016  0.3276651400000006  0.1600483900000000
  0.3345891299999977  0.8236667099999977  0.1617439799999971
  0.0834921900000012  0.0763774200000000  0.1600721499999977
  0.0831090000000003  0.8270201799999981  0.1601541400000031
  0.8328913000000000  0.0774330799999987  0.1600862700000008
  0.4155701899999968  0.4095004500000030  0.2408017099999995
  0.4168576799999997  0.1603661500000015  0.2391538500000010
  0.1661767299999966  0.4103823100000028  0.2391427399999984
  0.6669412399999999  0.1598352199999979  0.2392634799999982
  0.1663398299999983  0.6604479800000007  0.2392592100000002
  0.9169078400000004  0.9106565900000021  0.2390654200000029
  0.9164712199999983  0.6606848500000027  0.2391105100000033
  0.6665356299999985  0.9101709099999979  0.2391113199999992
  0.1669105300000027  0.1600876500000012  0.2391587500000014
  0.9168355700000035  0.4103618800000035  0.2391329000000013
  0.9167781700000006  0.1605138999999980  0.2392155499999973
  0.6677899299999979  0.4104032400000008  0.2396675800000025
  0.4164222400000028  0.9089400800000007  0.2390937500000021
  0.4168327800000000  0.6528584899999998  0.2518060100000028
  0.1679774999999992  0.9096043899999984  0.2391725199999968
  0.6657912200000027  0.6603092599999982  0.2392240699999988
  0.6303103899999982  0.3507082200000013  0.3087006100000025
  0.4201464900000005  0.6048880600000004  0.3033838500000030
  0.5986879399999978  0.3907820399999977  0.3409176700000032
  0.4059867400000030  0.3496222699999976  0.3724407300000010
  0.4187586700000026  0.5680400399999996  0.3878241500000001
  0.4872670800000023  0.4181946400000029  0.3798826399999982
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00