%chk=000016189.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016189

0 1
 O   -3.544600       2.154800      0.1041000    
 O    6.609500      -1.052200     -0.4862000    
 C   -1.672900      0.5964000      0.3757000    
 C  -0.7301000       1.575400     -0.3759000    
 C   0.7883000       1.308300     -0.2837000    
 C    1.161300     -0.1857000     -0.4383000    
 C   -3.035100      0.8901000     -0.3332000    
 C   -1.204800     -0.8684000      0.1816000    
 C   -1.224500       1.529300      -1.839600    
 C   0.2843000      -1.079700      0.4550000    
 C   -2.667800       1.020100      -1.814300    
 C    1.405200       1.878300       1.001000    
 C   -1.766300      0.9151000       1.881900    
 C    2.644100     -0.4432000     -0.1894000    
 C    2.927900       1.762600      0.9728000    
 C    3.444000      0.4506000      0.4322000    
 C    3.192600      -1.735300     -0.7555000    
 C   -4.060600     -0.1380000     -0.1079000    
 C    4.928400      0.2579000      0.6120000    
 C    4.518700      -2.161000     -0.1431000    
 C    5.449200     -0.9807000     -8.3400004E-02
 C   -4.898300     -0.9780000      7.6399997E-02
 C   -5.855700      -1.938200      0.2869000    
 C   -6.692900      -2.778300      0.4708000    
 H  -0.9176000       2.598300     -1.8200001E-02
 H    1.258800       1.855800      -1.115200    
 H   0.9630000     -0.4606000      -1.483500    
 H   -1.406300      -1.208400     -0.8417000    
 H   -1.777400      -1.535500      0.8384000    
 H  -0.6164000      0.8699000      -2.467900    
 H   -1.171100       2.528600      -2.286900    
 H   0.5065000     -0.9092000       1.514500    
 H   0.5081000      -2.137100      0.2716000    
 H   -3.326900       1.711900      -2.351500    
 H   -2.716700      5.5799998E-02  -2.335200    
 H    1.036200       1.352100       1.885000    
 H    1.129800       2.932300       1.125900    
 H  -0.8732000      0.6132000       2.432100    
 H   -1.912200       1.985400       2.063400    
 H   -2.607700      0.3838000       2.341000    
 H    3.305800       1.918800       1.990500    
 H    3.335300       2.572300      0.3538000    
 H    2.481600      -2.555300     -0.6130000    
 H    3.312200      -1.605500      -1.838800    
 H   -4.342000       2.357000     -0.4149000    
 H    5.461100       1.121000      0.1968000    
 H    5.167500      0.1712000       1.677200    
 H    4.973100      -2.956700     -0.7426000    
 H    4.381800      -2.540100      0.8759000    
 H   -7.435700      -3.523800      0.6340000    


%chk=000016189-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016189

0 1
O -3.513843 2.177200 0.113847
O 6.722037 -1.145818 -0.414861
C -1.673154 0.591521 0.376873
C -0.728089 1.590214 -0.383775
C 0.800756 1.333864 -0.251782
C 1.173837 -0.164682 -0.436127
C -3.040623 0.845937 -0.371965
C -1.211077 -0.879279 0.147904
C -1.209980 1.558461 -1.874137
C 0.287944 -1.073312 0.466345
C -2.649108 0.963272 -1.876060
C 1.430926 1.873149 1.056351
C -1.825943 0.876236 1.888507
C 2.666917 -0.413664 -0.223359
C 2.971125 1.796301 0.984742
C 3.479949 0.477960 0.416580
C 3.220313 -1.703590 -0.819079
C -4.077318 -0.162791 -0.114585
C 4.982879 0.264447 0.556544
C 4.522822 -2.177976 -0.123627
C 5.525276 -1.036287 -0.037302
C -4.971660 -0.997236 0.095698
C -5.956348 -1.925526 0.324831
C -6.844541 -2.765918 0.531342
H -0.943688 2.599338 0.018149
H 1.284636 1.897515 -1.080608
H 0.943052 -0.455645 -1.486738
H -1.382587 -1.181767 -0.904953
H -1.825409 -1.555293 0.773002
H -0.537258 0.934880 -2.491457
H -1.189621 2.575293 -2.303097
H 0.491689 -0.852942 1.531282
H 0.557733 -2.136030 0.313221
H -3.379240 1.597603 -2.410190
H -2.675056 -0.030568 -2.356823
H 1.077978 1.290211 1.926958
H 1.112192 2.919885 1.225411
H -0.906598 0.620039 2.441795
H -2.060412 1.937714 2.067048
H -2.650698 0.272307 2.311271
H 3.407995 1.957390 1.992550
H 3.360788 2.628005 0.357310
H 2.463447 -2.508971 -0.754643
H 3.413369 -1.557862 -1.903189
H -4.380922 2.372557 -0.326338
H 5.544823 1.106985 0.105023
H 5.265152 0.278057 1.633805
H 4.986248 -3.033351 -0.644065
H 4.271996 -2.489697 0.911426
H -7.615203 -3.492733 0.711546


