%chk=000193724.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193724

0 1
P -3.880254 0.725469 -0.370370
P -1.838024 -1.590611 -0.495642
P -0.326671 -1.053483 2.045647
O -3.245675 2.174977 -0.028296
O -0.419518 3.183138 2.046091
O 0.135332 3.867246 -0.956082
O -2.487221 -0.118003 -0.708068
O -4.189638 0.131825 1.131594
O -4.910095 0.645239 -1.389992
O -0.502792 -1.205378 0.415621
O 1.001013 -1.598947 -2.835391
O -1.290676 -2.001883 -1.908607
O -2.658315 -2.507198 0.326167
O -1.290456 -2.182465 2.661183
O 1.179243 -1.651577 2.238459
O -0.468463 0.338721 2.509200
N 0.696198 0.673518 -1.098618
N 2.666948 0.951331 0.928445
N 3.893549 -0.856498 -0.028854
N 3.077519 -2.029246 -1.993459
N 5.095285 -2.706083 -0.971525
C -1.246903 3.132963 0.886971
C -0.462755 2.701725 -0.381926
C -2.476667 2.265934 1.205296
C 0.634490 1.669136 -0.195081
C 1.625865 1.794056 0.835886
C 1.751005 -0.185172 -1.032202
C 2.755586 -0.027760 -0.040315
C 1.862970 -1.306392 -2.028644
C 3.993571 -1.851332 -1.047755
H -1.546974 4.205645 0.742776
H -1.180422 2.380606 -1.188486
H -2.184200 1.282005 1.629060
H -3.142174 2.781280 1.929930
H 1.548055 2.590370 1.602449
H -0.384004 2.289431 2.505905
H 0.719434 4.321961 -0.308178
H 4.566451 -0.767063 0.734984
H -4.722125 -0.702016 1.222538
H 5.193880 -3.374800 -1.737284
H 5.970300 -2.361967 -0.603654
H -0.589281 -1.361740 -2.407888
H -1.957169 -2.676543 2.021358
H 1.850578 -1.037419 2.655457


%chk=000193724-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193724

0 1
P -4.064171 0.958717 -0.646297
P -1.992335 -1.434765 -0.280187
P -0.698124 -1.048658 2.571134
O -3.396528 2.358677 0.080985
O -0.314070 2.924538 2.134054
O 0.219666 3.792427 -0.949022
O -2.531100 0.054306 -0.912976
O -4.782458 0.077970 0.614796
O -4.874381 1.259459 -1.956115
O -0.699056 -1.003362 0.846408
O 0.934845 -2.207856 -2.316675
O -1.301821 -2.290666 -1.436830
O -3.178397 -2.029069 0.673985
O -2.056368 -1.936198 2.998077
O 0.668128 -2.047428 2.821837
O -0.527331 0.399857 3.206076
N 0.723781 0.439411 -1.007813
N 3.034738 1.174393 0.510719
N 4.221241 -0.604868 -0.477858
N 3.193406 -2.153721 -1.991522
N 5.485505 -2.258425 -1.615688
C -1.162925 2.962394 0.943853
C -0.399763 2.572431 -0.367642
C -2.470688 2.198137 1.228503
C 0.736885 1.564693 -0.246916
C 1.890088 1.896200 0.550410
C 1.863266 -0.323117 -1.033836
C 3.021147 0.095525 -0.320916
C 1.958594 -1.590273 -1.799296
C 4.280832 -1.664302 -1.368773
H -1.437259 4.024974 0.801843
H -1.109954 2.221687 -1.131262
H -2.272823 1.134107 1.441028
H -2.961486 2.646756 2.107111
H 1.861743 2.750960 1.229089
H -0.355129 2.015411 2.575294
H 0.566121 4.359352 -0.210685
H 5.023518 -0.270197 0.066525
H -4.431340 -0.884409 0.709932
H 5.476882 -3.056145 -2.250270
H 6.366561 -1.935913 -1.222292
H -0.136673 -2.118098 -1.924535
H -2.671250 -2.160836 2.178043
H 1.115286 -1.911077 3.696402


