%chk=000162925.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162925

0 1
 O   -3.363600     -0.5350000       2.189100    
 O   0.8661000      -3.841300     -0.9948000    
 O    6.911300       1.540300     -0.3502000    
 N   -4.903800       1.182400      0.4680000    
 N    1.249800      -1.185800     -0.1473000    
 C   -5.080800       2.404900     -0.3224000    
 C   -3.755700      0.4288000     -7.0000002E-03
 C   -3.567600     -0.8533000      0.8131000    
 C   -5.309500       2.032100      -1.791900    
 C   -3.817100       3.261000     -0.1869000    
 C   -6.293200       3.167500      0.2222000    
 C   -2.375200      -1.649900      0.3303000    
 C   -1.125600      -1.054600      0.3153000    
 C   -2.560100      -2.956600     -8.6900003E-02
 C  -2.6799999E-02  -1.788900     -0.1307000    
 C  -0.1945000      -3.107000     -0.5548000    
 C   -1.461100      -3.690900     -0.5329000    
 C    1.476800      0.1602000      0.2766000    
 C    2.925000      0.5284000      0.1097000    
 C    3.356600       1.087300      -1.086000    
 C    3.813300      0.3040000       1.153400    
 C    4.700400       1.427800      -1.240800    
 C    5.157000      0.6447000      0.9986000    
 C    5.600500       1.206700     -0.1985000    
 C    7.777800       1.287400      0.7548000    
 H   -5.742300      0.6049000      0.4089000    
 H   -3.853200      0.1258000      -1.054100    
 H   -2.846900       1.024300      0.1008000    
 H   -4.476200      -1.465800      0.7550000    
 H   -4.404800       1.687600      -2.303300    
 H   -6.084200       1.263800      -1.900500    
 H   -5.653500       2.909500      -2.354100    
 H   -2.967400       2.887300     -0.7681000    
 H   -3.506700       3.366700      0.8596000    
 H   -4.007500       4.274600     -0.5619000    
 H   -6.156400       3.432800       1.277200    
 H   -6.458500       4.097900     -0.3331000    
 H   -7.209300       2.570200      0.1444000    
 H   -1.016500     -3.5999998E-02  0.6715000    
 H   -3.541100      -3.422200     -7.5000003E-02
 H   -4.115700      1.1100000E-02   2.475100    
 H   -1.598700      -4.717300     -0.8622000    
 H    2.053400      -1.774800     -0.3258000    
 H   0.8682000      0.8648000     -0.3053000    
 H    1.196700      0.2929000       1.329800    
 H    2.664500       1.261900      -1.905100    
 H    3.477700     -0.1353000       2.088800    
 H    1.611500      -3.256500      -1.200600    
 H    5.040100       1.864900      -2.175800    
 H    5.801900      0.4455000       1.847600    
 H    7.841700      0.2172000      0.9793000    
 H    8.780900       1.612600      0.4601000    
 H    7.494600       1.879200       1.631900    


%chk=000162925-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162925

0 1
O -2.954497 0.340679 1.779637
O 0.873417 -3.494486 -1.690612
O 7.483862 1.049248 -0.166236
N -5.127000 1.124878 0.437223
N 1.480251 -1.285669 -0.154871
C -5.589593 2.361522 -0.287051
C -4.253315 0.154388 -0.272627
C -3.445838 -0.634155 0.810598
C -6.316819 2.015159 -1.618096
C -4.374417 3.279551 -0.565395
C -6.567986 3.083213 0.671661
C -2.294718 -1.419297 0.200074
C -0.964993 -0.956499 0.338276
C -2.550573 -2.610670 -0.521420
C 0.106383 -1.665698 -0.251229
C -0.180219 -2.824753 -1.034921
C -1.494124 -3.308110 -1.152009
C 1.837570 0.032999 0.414578
C 3.331416 0.293054 0.295943
C 3.976490 0.258313 -0.971198
C 4.111544 0.587860 1.436133
C 5.353039 0.512525 -1.091517
C 5.498998 0.849553 1.336835
C 6.120209 0.810433 0.065072
C 8.320768 1.364981 0.993288
H -5.935713 0.645266 0.862963
H -4.797627 -0.552949 -0.933852
H -3.535149 0.715307 -0.894621
H -4.144317 -1.344157 1.313339
H -5.646560 1.469594 -2.306980
H -7.205382 1.382990 -1.428432
H -6.655044 2.933726 -2.132224
H -3.665690 2.826095 -1.281327
H -3.829844 3.489412 0.371959
H -4.715862 4.236987 -0.998768
H -6.062117 3.339057 1.619616
H -6.945891 4.013823 0.212733
H -7.441999 2.444203 0.905889
H -0.797652 -0.065042 0.948548
H -3.573522 -2.998388 -0.601134
H -3.668741 1.055902 1.746315
H -1.674604 -4.208983 -1.746244
H 2.105277 -2.036463 0.166967
H 1.260941 0.795333 -0.145246
H 1.529757 0.123134 1.480859
H 3.385255 0.027735 -1.864677
H 3.633819 0.615928 2.423257
H 1.620642 -2.842664 -1.798857
H 5.857579 0.491348 -2.062374
H 6.071228 1.075158 2.241548
H 8.329972 0.531738 1.722950
H 9.331887 1.511971 0.586295
H 7.981807 2.292720 1.494461


