%chk=000125941.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125941

0 1
 P   -1.736800      7.1400002E-02 -0.6217000    
 P    1.995900     -1.8400000E-02  4.3699998E-02
 P  -4.3099999E-02  -1.849800      0.4291000    
 P   6.0899999E-02   1.937600      0.3559000    
 N   -3.245700     -0.4866000     -0.2531000    
 N    2.578600     -0.9223000      -1.207100    
 N  -0.7580000      -1.179500     -0.8396000    
 N    1.164600       1.215000     -0.5548000    
 N   -1.242800       1.028400      0.5655000    
 N    1.113800     -0.9193000       1.033900    
 N   -1.851800      0.9079000      -2.039000    
 N    3.293300      0.5650000      0.8802000    
 N   -1.140600      -2.171200       1.617800    
 N   0.6160000      -3.288800     -3.9000001E-02
 N  -0.3810000       3.348900     -0.3769000    
 N   0.6813000       2.321900       1.835500    
 C   -3.710900     -0.2801000       1.117100    
 C   -4.280000      0.5190000     -1.8700000E-02
 C    2.071000     -0.6105000      -2.542000    
 C    3.472500     -0.2478000      -2.146500    
 C   -2.368700      0.2091000      -3.204600    
 C    4.187400     -0.3936000       1.509600    
 C  -0.6583000      -2.783300       2.845500    
 C  -0.2752000      -4.307800     -0.5695000    
 C   0.6487000       4.348300     -0.6116000    
 C  -0.1909000       2.986400       2.790400    
 H   -4.318100      -1.077800       1.525200    
 H   -3.113600      0.2542000       1.840900    
 H   -4.001500       1.560300     -0.1024000    
 H   -5.267800      0.2632000     -0.3764000    
 H    1.934700      -1.464400      -3.193200    
 H    1.357500      0.1860000      -2.687800    
 H    3.698000      0.7959000      -1.977400    
 H    4.282500     -0.8506000      -2.533000    
 H   -2.319000       1.812400      -1.982000    
 H    3.856200       1.270000      0.4052000    
 H   -1.709900      -1.376100       1.894600    
 H    1.429600      -3.224000     -0.6505000    
 H  -0.9315000       3.253600      -1.229500    
 H    1.169000       1.569200       2.320900    
 H   -2.274400      0.8468000      -4.088600    
 H   -3.424800     -4.5499999E-02  -3.079100    
 H   -1.802900     -0.7073000      -3.395600    
 H    3.637700      -1.067800       2.172700    
 H    4.719300     -0.9880000      0.7614000    
 H    4.928600      0.1355000       2.116000    
 H   2.7300000E-02  -2.114500       3.373900    
 H   -1.502700      -2.999500       3.506800    
 H  -0.1458000      -3.728100       2.644300    
 H   0.2868000      -5.226900     -0.7608000    
 H   -1.071800      -4.549900      0.1394000    
 H  -0.7262000      -3.980300      -1.510600    
 H   0.1970000       5.253600      -1.027900    
 H    1.152400       4.628400      0.3177000    
 H    1.395000       3.980500      -1.321700    
 H  -0.6101000       3.906700       2.374400    
 H   -1.011100       2.329000       3.093500    
 H   0.3786000       3.257300       3.684500    


%chk=000125941-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125941

0 1
P -1.939408 0.208060 -0.791238
P 2.002598 -0.027039 0.331717
P -0.156774 -2.017552 0.047833
P 0.167069 2.347731 -0.147756
N -2.908717 -0.261228 0.708662
N 2.956382 -0.942566 -0.928730
N -0.999825 -1.154099 -1.169759
N 1.585382 1.446983 -0.398433
N -1.361437 1.796555 -0.644540
N 0.898861 -1.099644 1.044956
N -3.088826 0.363607 -2.048486
N 3.093331 0.362057 1.613274
N -1.314257 -2.846464 1.019310
N 0.781674 -3.273376 -0.676080
N 0.249746 3.821129 -1.037650
N 0.238369 2.871882 1.513730
C -2.465405 0.361364 2.027555
C -3.737846 0.832629 1.356755
C 2.532678 -0.736115 -2.382375
C 3.816435 -0.117077 -1.876373
C -3.726228 -0.766801 -2.729096
C 3.574915 -0.624992 2.591724
C -0.921905 -3.733163 2.124881
C 0.192855 -4.233460 -1.623458
C 1.415445 4.710337 -0.979489
C -0.720724 3.802281 2.120130
H -2.510409 -0.319047 2.883608
H -1.597822 1.032198 2.002073
H -3.712599 1.823292 0.884897
H -4.713754 0.500007 1.724932
H 2.563104 -1.648057 -2.987216
H 1.685518 -0.064414 -2.559212
H 3.807375 0.971012 -1.737753
H 4.782720 -0.572965 -2.115265
H -3.267848 1.317293 -2.361111
H 3.631404 1.220552 1.479647
H -2.215157 -2.349037 1.076408
H 1.773422 -3.027248 -0.786853
H -0.344430 3.840693 -1.867952
H 0.878873 2.347253 2.114959
H -3.645188 -0.657063 -3.827270
H -4.795193 -0.876194 -2.458131
H -3.190930 -1.689803 -2.447472
H 2.810217 -1.415067 2.678868
H 4.538705 -1.090649 2.301774
H 3.691811 -0.148117 3.582508
H -0.703698 -3.189823 3.067249
H -1.727688 -4.466419 2.312077
H -0.014927 -4.290520 1.832218
H 0.816985 -5.144839 -1.659199
H -0.810455 -4.520856 -1.263687
H 0.087179 -3.825721 -2.649514
H 1.107713 5.744171 -1.220853
H 1.815199 4.707417 0.050035
H 2.232016 4.407659 -1.666045
H -1.175186 4.409555 1.317732
H -1.538814 3.294459 2.672110
H -0.203331 4.491043 2.814376


