%chk=000160368.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160368

0 1
 O   -4.822400      0.8645000      -2.214400    
 O    4.104200      -1.772700      -1.914800    
 O    7.414500     -0.5458000       1.683200    
 O    5.355000     -0.8476000       2.587500    
 O    5.034300       4.473500      0.3741000    
 O    6.219200       3.596600      -1.350600    
 N   -5.598000     -0.9516000       1.895500    
 N   -6.639400       1.230800       1.324100    
 N   -6.168400       2.120500     -0.8237000    
 N   -7.555600       3.252300      0.7067000    
 N    4.149500     -0.7903000      0.1850000    
 C   -4.422100      -1.279700     -0.1269000    
 C   -4.786500      -1.953900       1.229900    
 C   -2.922500      -1.029600     -0.2434000    
 C   -5.218700     -5.5999998E-03 -6.9499999E-02
 C   -5.860700      0.1326000       1.100100    
 C   -2.148100      -2.342400     -0.3450000    
 C   -5.376800       1.019100      -1.130400    
 C  -0.6668000      -2.102200     -0.4847000    
 C   -6.759200       2.196400      0.3459000    
 C   0.1364000      -2.014700      0.6523000    
 C  -9.8899998E-02  -1.968500      -1.751800    
 C    2.075400      -1.659900     -0.7448000    
 C    1.507500      -1.793700      0.5222000    
 C    1.272100      -1.747400      -1.881800    
 C    5.558900     -0.4704000      0.1901000    
 C    5.856200      0.9051000     -0.4192000    
 C    3.504800      -1.429000     -0.8806000    
 C    5.242000       2.106400      0.3109000    
 C    6.060200     -0.6311000       1.610600    
 C    5.554200       3.438400     -0.3363000    
 H   -4.770800      -1.904100     -0.9584000    
 H   -5.374100      -2.863100       1.063400    
 H   -3.920200      -2.201200       1.849600    
 H   -2.715100     -0.4205000      -1.132600    
 H   -2.563000     -0.4462000      0.6152000    
 H   -6.051300      -1.080400       2.789800    
 H   -2.503400      -2.921900      -1.207100    
 H   -2.320000      -2.980700      0.5292000    
 H   -7.111600       1.303900       2.217400    
 H  -0.2944000      -2.122300       1.644300    
 H  -0.7149000      -2.032100      -2.644900    
 H    2.100000      -1.763100       1.431800    
 H    1.694000      -1.640900      -2.877800    
 H    6.066200      -1.236300     -0.4101000    
 H    6.943800       1.047700     -0.4658000    
 H    5.506800      0.9146000      -1.460200    
 H   -7.721000       4.026000      7.2200000E-02
 H   -8.003100       3.290700       1.616000    
 H    3.605600     -0.4557000      0.9737000    
 H    4.151700       2.002300      0.3396000    
 H    5.619400       2.141800       1.338800    
 H    7.739400     -0.6662000       2.600900    
 H    5.249500       5.340000     -3.2299999E-02


%chk=000160368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000160368

0 1
O -5.000424 0.436276 -2.407980
O 3.927680 -0.852669 -2.168912
O 7.847639 -0.853459 1.075083
O 5.901923 -1.171544 2.301127
O 5.376157 4.332376 0.944576
O 6.449141 3.748128 -1.030088
N -5.778334 -0.696146 2.115733
N -6.936131 1.258801 1.155893
N -6.529872 1.755143 -1.179199
N -7.968644 3.109189 0.088947
N 4.326173 -0.788675 0.108827
C -4.573339 -1.389106 0.104248
C -4.947038 -1.822062 1.576109
C -3.068570 -1.056257 -0.085000
C -5.459124 -0.172257 -0.120800
C -6.100598 0.150240 1.059830
C -2.171657 -2.324947 -0.087426
C -5.606035 0.652028 -1.311271
C -0.701246 -1.999331 -0.293928
C -7.117830 2.019339 -0.030012
C 0.231264 -2.097987 0.769943
C -0.226457 -1.568963 -1.562357
C 2.055834 -1.335488 -0.685952
C 1.590923 -1.770955 0.582343
C 1.129127 -1.247528 -1.757220
C 5.756597 -0.532908 -0.084580
C 6.076457 0.929532 -0.525959
C 3.488023 -0.982134 -0.979281
C 5.583077 1.981653 0.481686
C 6.465042 -0.891937 1.216243
C 5.864872 3.396654 0.016932
H -4.828567 -2.196677 -0.609986
H -5.529949 -2.763726 1.586491
H -4.046100 -1.961572 2.200560
H -2.959780 -0.526753 -1.049091
H -2.737450 -0.358787 0.709648
H -6.398801 -0.848802 2.911487
H -2.526589 -2.992072 -0.899064
H -2.300590 -2.878952 0.863603
H -7.278170 1.591996 2.058238
H -0.109905 -2.443760 1.753363
H -0.928110 -1.489557 -2.401406
H 2.277026 -1.894683 1.429229
H 1.504614 -0.929380 -2.735226
H 6.132695 -1.192728 -0.890794
H 7.165770 1.020713 -0.678650
H 5.593160 1.082106 -1.505523
H -8.086134 3.670176 -0.751766
H -8.619632 3.225284 0.861296
H 4.006417 -0.912155 1.072540
H 4.493124 1.887962 0.648804
H 6.053235 1.860211 1.477899
H 8.282482 -1.082518 1.940839
H 5.570421 5.251066 0.612851


