%chk=000168066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168066

0 1
 P   -2.526600     -0.1254000      0.7405000    
 O   -1.464000      0.6837000     -0.1516000    
 O   -2.517400      -1.609100      8.9299999E-02
 O   -3.941400      0.4880000      0.2433000    
 O    2.266100      -1.780800       1.311700    
 O   -2.296300     -7.6200001E-02   2.224000    
 N    2.622900     -6.1200000E-02 -0.2421000    
 C    4.063800     -0.3023000     -0.2941000    
 C    2.061900      0.9574000      -1.023900    
 C    4.827200      0.5167000      0.7397000    
 C    1.840400     -0.8710000      0.6002000    
 C   0.7377000       1.186100     -0.9836000    
 C  -0.1167000      0.3942000     -0.1434000    
 C   0.3771000     -0.5876000      0.6183000    
 C    2.950100       1.789900      -1.906600    
 C    6.330700      0.2881000      0.6778000    
 C   -2.728100      -1.733800      -1.306500    
 C   -4.222500       1.848300      0.5229000    
 C   -2.677100      -3.198900      -1.683800    
 C   -5.587900       2.193900     -3.2099999E-02
 H    4.452500     -0.1365000      -1.303600    
 H    4.240100      -1.366500     -9.0800002E-02
 H    4.471400      0.2605000       1.745300    
 H    4.627100       1.585700      0.6107000    
 H   0.2788000       1.968200      -1.580100    
 H  -0.2088000      -1.222100       1.269200    
 H    3.400800       1.180100      -2.696200    
 H    2.385200       2.583700      -2.409500    
 H    3.739100       2.286000      -1.335800    
 H    6.573400     -0.7648000      0.8531000    
 H    6.837700      0.8864000       1.441100    
 H    6.728700      0.5752000     -0.3006000    
 H   -3.706300      -1.319900      -1.569000    
 H   -1.955900      -1.187000      -1.854600    
 H   -4.203400       2.004800       1.605900    
 H   -3.458000       2.480900      6.1299998E-02
 H   -2.839600      -3.332200      -2.756900    
 H   -1.707200      -3.631600      -1.416800    
 H   -3.439200      -3.764700      -1.137800    
 H   -5.837600       3.239600      0.1674000    
 H   -5.618900       2.022900      -1.113300    
 H   -6.357900       1.555300      0.4131000    


%chk=000168066-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168066

0 1
P -2.601166 -0.450256 0.618194
O -1.353655 0.414239 -0.282116
O -2.880091 -1.881163 -0.265816
O -3.928848 0.524991 0.140523
O 2.719492 -1.260016 1.858077
O -2.338458 -0.672131 2.160837
N 2.817216 -0.027153 -0.148733
C 4.295859 -0.162363 -0.058758
C 2.196434 0.684470 -1.170205
C 4.937862 0.932765 0.824663
C 2.078649 -0.647781 0.944035
C 0.810242 0.806706 -1.187867
C 0.039767 0.198830 -0.147183
C 0.636991 -0.503417 0.889119
C 3.042252 1.300370 -2.264733
C 6.465125 0.742693 0.932653
C -3.237682 -1.822157 -1.724607
C -4.108114 1.860319 0.797922
C -3.353496 -3.273820 -2.173911
C -5.455732 2.388632 0.320180
H 4.727716 -0.150062 -1.073824
H 4.494264 -1.146296 0.400281
H 4.479397 0.878408 1.828355
H 4.708081 1.935286 0.412218
H 0.309344 1.358200 -1.984189
H 0.068835 -0.949282 1.709706
H 3.536798 0.527817 -2.883348
H 2.403251 1.903578 -2.928545
H 3.832041 1.957414 -1.858636
H 6.709482 -0.239067 1.378612
H 6.915210 1.522779 1.572081
H 6.953834 0.796573 -0.059115
H -4.188814 -1.270298 -1.826099
H -2.438096 -1.280296 -2.263329
H -4.081451 1.722506 1.894939
H -3.272323 2.514781 0.487553
H -3.622816 -3.311234 -3.246027
H -2.397406 -3.804723 -2.032130
H -4.134229 -3.798024 -1.597992
H -5.645085 3.382399 0.766516
H -5.468682 2.491288 -0.778117
H -6.270099 1.708498 0.620917


