%chk=000097748.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097748

0 1
 O    9.248200      0.7749000      7.3100001E-02
 O    8.124200      -1.195700      0.2428000    
 C   -2.931500      0.3457000      4.2700000E-02
 C   -4.208700     -0.4922000      0.1331000    
 C   -1.650300     -0.4932000      5.9700001E-02
 C   -5.456400      0.3890000      3.8699999E-02
 C  -0.3755000      0.3388000     -0.1049000    
 C   -6.735700     -0.4422000      0.1613000    
 C   0.8649000     -0.5577000     -0.1527000    
 C   -7.981700      0.4369000      3.3300001E-02
 C    2.170200      0.2185000     -0.3529000    
 C   -9.291000     -0.3497000      0.1249000    
 C    3.406400     -0.6811000     -0.4259000    
 C   -10.53080      0.5088000     -7.2200000E-02
 C    4.661500      0.1336000     -0.5526000    
 C    5.656900      0.1146000      0.3464000    
 C    6.908800      0.9261000      0.2192000    
 C    8.120500      2.4900001E-02  0.1861000    
 H   -2.904300       1.060300      0.8746000    
 H   -2.955300      0.9369000     -0.8814000    
 H   -4.220800      -1.232300     -0.6760000    
 H   -4.214900      -1.046400       1.079300    
 H   -1.701900      -1.234300     -0.7478000    
 H   -1.600000      -1.054200       1.001100    
 H   -5.434100       1.145600      0.8324000    
 H   -5.455000      0.9241000     -0.9187000    
 H  -0.2882000       1.049000      0.7258000    
 H  -0.4373000      0.9259000      -1.029000    
 H   -6.750500      -1.212300     -0.6193000    
 H   -6.749800     -0.9601000       1.127800    
 H   0.7554000      -1.283000     -0.9686000    
 H   0.9297000      -1.135200      0.7777000    
 H   -7.968600       1.204100      0.8173000    
 H   -7.950800      0.9661000     -0.9274000    
 H    2.096500      0.8122000      -1.273200    
 H    2.285300      0.9332000      0.4725000    
 H   -9.290900      -1.144000     -0.6311000    
 H   -9.350400     -0.8423000       1.102700    
 H    3.329200      -1.345800      -1.294400    
 H    3.447100      -1.322000      0.4631000    
 H   -10.58520       1.294900      0.6875000    
 H   -11.43430     -0.1040000      5.2000000E-03
 H   -10.52400      0.9838000      -1.058300    
 H    4.754100      0.7553000      -1.439800    
 H    5.558400     -0.5044000       1.235300    
 H    6.991200       1.590300       1.085900    
 H    6.900300       1.529900     -0.6948000    
 H    10.05560      0.2184000      4.5200001E-02


%chk=000097748-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097748

0 1
O 9.437092 0.788688 -0.127335
O 8.422368 -0.813911 1.212014
C -2.946766 0.326209 -0.072885
C -4.260387 -0.485139 -0.006318
C -1.680208 -0.558891 -0.094013
C -5.526990 0.399976 0.014068
C -0.367555 0.252082 -0.182597
C -6.841384 -0.411314 0.068065
C 0.898356 -0.633867 -0.201247
C -8.107974 0.473950 0.086082
C 2.208132 0.176606 -0.323514
C -9.422777 -0.337760 0.136454
C 3.474164 -0.722446 -0.331201
C -10.682461 0.555156 0.152305
C 4.751425 0.060253 -0.546287
C 5.790482 0.113190 0.325044
C 7.044643 0.931481 0.101425
C 8.316709 0.183684 0.467942
H -2.897687 1.016037 0.795685
H -2.959410 0.968595 -0.978434
H -4.309051 -1.173666 -0.876042
H -4.248588 -1.128943 0.898163
H -1.736511 -1.257669 -0.955041
H -1.660001 -1.191769 0.817929
H -5.482558 1.083577 0.887840
H -5.534485 1.048961 -0.886810
H -0.311529 0.954434 0.675247
H -0.387872 0.880968 -1.097407
H -6.885137 -1.095168 -0.805638
H -6.835027 -1.060030 0.969160
H 0.832139 -1.350239 -1.047145
H 0.930670 -1.247739 0.723071
H -8.067088 1.156585 0.960865
H -8.114631 1.124100 -0.813999
H 2.180909 0.779225 -1.255262
H 2.281709 0.899305 0.513829
H -9.462246 -1.020400 -0.737082
H -9.415471 -0.986205 1.036487
H 3.360970 -1.473086 -1.142463
H 3.534577 -1.287905 0.619046
H -10.679903 1.227383 1.031253
H -11.608302 -0.048077 0.190835
H -10.729243 1.189360 -0.753230
H 4.812217 0.631434 -1.488020
H 5.752847 -0.460490 1.261403
H 7.034068 1.844076 0.737152
H 7.125972 1.288844 -0.939798
H 10.258292 0.300254 0.154103


