%chk=000156341.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156341

0 1
 O   -3.966100      -1.009600     -0.1870000    
 O   -3.779300       1.229900     -0.9742000    
 O  -0.4637000      -1.826100      4.7600001E-02
 O   0.8247000      0.6054000     -0.4333000    
 O  -0.7656000      -4.094900      0.3624000    
 O    1.342100       4.310700       1.170400    
 C   -1.916200     -0.3207000      -1.266400    
 C   -1.723700      -1.649600     -0.5595000    
 C   -2.891800      -1.747000      0.4244000    
 C   -3.442800     -0.1519000      -1.220900    
 C   -1.507900      0.9591000     -0.6297000    
 C   -2.615100       1.790000     -0.5181000    
 C   -2.612300      -1.154800       1.810000    
 C   -3.353300      -3.196800      0.5938000    
 C  -0.2575000       1.420500     -0.2492000    
 C   -2.532000       3.072000     -4.8000002E-03
 C  -0.1524000       2.708600      0.2827000    
 C   -1.282700       3.533300      0.4097000    
 C  -0.2560000      -3.028100      0.6776000    
 C    1.173500       3.196000      0.6954000    
 C    2.071300       1.051700     -2.5500000E-02
 C    2.301800       2.261900      0.5069000    
 C   0.6950000      -2.858500       1.823400    
 C    3.156900      7.5000003E-02 -0.2468000    
 C    4.274300      6.5300003E-02  0.5921000    
 C    3.071800     -0.8441000      -1.295700    
 C    5.299500     -0.8574000      0.3835000    
 C    4.096800      -1.766800      -1.504200    
 C    5.210700      -1.773400     -0.6646000    
 H   -1.535000     -0.3328000      -2.293900    
 H   -1.835400      -2.414000      -1.342600    
 H   -3.907300     -0.4594000      -2.164600    
 H   -2.238900     -0.1296000       1.756500    
 H   -3.543600      -1.100400       2.387100    
 H   -1.901900      -1.746200       2.391900    
 H   -4.403000      -3.210900      0.9160000    
 H   -3.334900      -3.749900     -0.3515000    
 H   -2.800100      -3.749100       1.356500    
 H   -3.409400       3.704300      7.5700000E-02
 H   -1.201200       4.537100      0.8179000    
 H    3.281500       2.620700      0.7996000    
 H   0.5348000      -1.895100       2.315000    
 H    1.721900      -2.922200       1.456400    
 H   0.5159000      -3.645400       2.561100    
 H    4.370900      0.7473000       1.432700    
 H    2.219000     -0.8577000      -1.970100    
 H    6.164600     -0.8663000       1.040100    
 H    4.028500      -2.479400      -2.320900    
 H    6.008300      -2.492500     -0.8263000    


%chk=000156341-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000156341

0 1
O -4.119805 -1.267701 -0.880662
O -3.686587 1.137122 -0.884872
O -0.978994 -1.705140 0.934105
O 0.976938 0.474969 -0.288929
O 0.472382 -3.183776 -0.149712
O 1.489860 4.233108 1.481710
C -1.828156 -0.478084 -1.130631
C -1.894104 -1.755146 -0.219420
C -3.366752 -1.870669 0.283026
C -3.340993 -0.229240 -1.470008
C -1.397037 0.821523 -0.484371
C -2.512476 1.678578 -0.357098
C -3.656935 -1.087845 1.576289
C -3.842491 -3.324305 0.377491
C -0.142991 1.304418 -0.076812
C -2.439610 2.965930 0.221354
C -0.016690 2.597932 0.506559
C -1.178554 3.403225 0.657117
C 0.194612 -2.483269 0.848006
C 1.316480 3.096266 0.924682
C 2.263495 0.949731 0.048948
C 2.428282 2.187127 0.631858
C 1.027159 -2.317840 2.094696
C 3.328103 -0.016485 -0.300069
C 4.677641 0.219657 0.089243
C 3.024675 -1.197274 -1.033257
C 5.691684 -0.695329 -0.251993
C 4.043250 -2.113138 -1.368070
C 5.380674 -1.867111 -0.983564
H -1.235156 -0.704447 -2.031749
H -1.634260 -2.638353 -0.830043
H -3.622893 -0.160277 -2.530314
H -3.263419 -0.060193 1.545374
H -4.748689 -1.041325 1.728473
H -3.196265 -1.599583 2.438394
H -4.902180 -3.364150 0.681979
H -3.740436 -3.834477 -0.595700
H -3.244351 -3.869954 1.129152
H -3.333643 3.587901 0.307422
H -1.041719 4.390065 1.111237
H 3.428770 2.543988 0.884312
H 0.391027 -2.177754 2.982283
H 1.660949 -1.419028 1.986309
H 1.686646 -3.189463 2.219566
H 4.940110 1.113115 0.664435
H 1.994451 -1.398130 -1.334263
H 6.724420 -0.497993 0.054958
H 3.787179 -3.020110 -1.925338
H 6.171098 -2.578864 -1.245503


