%chk=000015175.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015175

0 1
 O    5.639500      0.7470000     -2.2200000E-02
 O  -0.6652000      -2.450100       2.074500    
 N    2.815600      0.4052000     -0.1233000    
 N   -2.355900      -3.000300      0.6377000    
 C  -0.4957000      -1.625100     -0.2296000    
 C   0.8344000     -0.9820000      0.2902000    
 C    1.595200     -0.1237000     -0.7288000    
 C   -1.450200     -0.5240000     -0.7234000    
 C  -0.1429000      -2.694400      -1.292300    
 C    3.707700     -0.6863000      0.2917000    
 C    3.515100       1.300200      -1.055600    
 C   -1.160300      -2.386500      0.9496000    
 C   -1.864000      0.4831000      0.1295000    
 C    4.978300     -0.1098000      0.9095000    
 C    4.791000       1.829500     -0.4069000    
 C   -1.845900     -0.6199000      -2.038900    
 C   -2.742300       1.466100     -0.3857000    
 C   -1.450700      0.5659000       1.469200    
 C   -2.709200      0.3468000      -2.545500    
 C   -3.155400       1.383700      -1.725400    
 C   -3.181400       2.502700      0.4539000    
 C   -1.897100       1.602600       2.289200    
 C   -2.760900       2.569200       1.782500    
 H    1.451300      -1.850700      0.5550000    
 H   0.7815000     -0.4304000       1.226200    
 H    1.831000     -0.7020000      -1.629200    
 H   0.9635000      0.7174000      -1.035000    
 H   0.5173000      -3.457300     -0.8596000    
 H   -1.020500      -3.238600      -1.660600    
 H   0.3829000      -2.278900      -2.158100    
 H    3.969200      -1.318600     -0.5666000    
 H    3.268600      -1.316700       1.068600    
 H    2.874600       2.148600      -1.322500    
 H    3.771400      0.7636000      -1.978400    
 H    4.765300      0.4465000       1.830600    
 H    5.670200     -0.9191000       1.164300    
 H    5.343800       2.447600      -1.121500    
 H    4.571400       2.451700      0.4693000    
 H   -1.538800      -1.393100      -2.730300    
 H  -0.8628000     -0.1580000       2.001200    
 H   -3.036700      0.2959000      -3.580000    
 H   -3.829900       2.128500      -2.142800    
 H   -2.780400      -2.942600     -0.2820000    
 H   -2.866600      -3.526300       1.338900    
 H   -3.857500       3.268600      7.9499997E-02
 H   -1.586800       1.646200       3.329500    
 H   -3.111600       3.373400       2.422700    


%chk=000015175-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015175

0 1
O 5.673078 1.079125 -0.018900
O -0.499625 -3.061491 1.872037
N 2.894457 0.234211 -0.247281
N -2.524851 -2.737395 0.799612
C -0.494761 -1.717663 -0.228220
C 0.885006 -1.176211 0.281209
C 1.750825 -0.524375 -0.816551
C -1.400256 -0.563018 -0.719784
C -0.236000 -2.800076 -1.326650
C 3.920209 -0.640940 0.378825
C 3.528461 1.109416 -1.267749
C -1.164573 -2.537332 0.928607
C -1.903206 0.453322 0.196174
C 5.042831 0.212419 0.991648
C 4.647976 1.944179 -0.626578
C -1.717151 -0.441753 -2.082261
C -2.683743 1.559294 -0.333830
C -1.684739 0.421483 1.617999
C -2.491908 0.642773 -2.596537
C -2.961597 1.632810 -1.738273
C -3.182089 2.571690 0.552555
C -2.187007 1.418544 2.456908
C -2.938660 2.510685 1.924244
H 1.403903 -2.026539 0.758914
H 0.730880 -0.415691 1.065571
H 2.110287 -1.296447 -1.544256
H 1.131902 0.196625 -1.384953
H 0.382799 -3.606054 -0.894954
H -1.177308 -3.249589 -1.689710
H 0.309331 -2.384778 -2.190599
H 4.362991 -1.345896 -0.372005
H 3.450853 -1.243856 1.176691
H 2.758484 1.786063 -1.685490
H 3.959068 0.512775 -2.112915
H 4.627145 0.836539 1.812097
H 5.855035 -0.422335 1.383159
H 5.179648 2.547192 -1.381420
H 4.214036 2.611616 0.149113
H -1.358249 -1.192571 -2.791186
H -1.126783 -0.402532 2.069604
H -2.705247 0.689200 -3.669969
H -3.549976 2.475750 -2.119778
H -3.068121 -2.243411 0.092172
H -3.002867 -3.308067 1.496331
H -3.764415 3.398023 0.127305
H -2.003022 1.361396 3.535231
H -3.322950 3.288491 2.592943


