%chk=000135084.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135084

0 1
 O   0.2492000      -1.420700       2.660300    
 O   0.4466000       3.102700     -8.3400004E-02
 O   -6.744200     -0.8274000      -1.246000    
 N    1.502000       1.238800      0.7593000    
 N  -0.8318000      0.2930000       1.568100    
 N    6.554300     -0.2306000     -0.6144000    
 N    7.832100      0.9392000      -2.154200    
 N    8.275000      -1.284100      -1.918000    
 C    1.462000     -0.2042000      0.9459000    
 C  -0.8942000       1.134100      0.3819000    
 C    2.764000     -0.7203000       1.537000    
 C    3.855100     -0.8378000      0.4722000    
 C   0.2712000     -0.4992000       1.848000    
 C   -2.134600       2.012900      0.3936000    
 C   0.3864000       1.957200      0.3571000    
 C    5.172700      -1.328800       1.079400    
 C   -3.362200       1.256800     -4.3499999E-02
 C    6.265100      -1.511700      3.1800002E-02
 C   -4.143400      0.5908000      0.9009000    
 C   -3.717600       1.222600      -1.391900    
 C   -5.280000     -0.1095000      0.4968000    
 C   -4.854200      0.5223000      -1.795900    
 C   -5.635400     -0.1437000     -0.8515000    
 C    7.499700     -0.2247000      -1.501900    
 C   -7.116400      -1.964800     -0.4691000    
 C   -7.821500      -2.963000      -1.362600    
 H    1.258700     -0.6692000     -2.6699999E-02
 H  -0.8757000      0.4776000     -0.4977000    
 H    2.616100      -1.715100       1.975400    
 H    3.101100     -6.7100003E-02   2.352100    
 H    4.008000      0.1357000     -7.4000000E-03
 H    3.531400      -1.535600     -0.3098000    
 H    2.403300       1.704300      0.7093000    
 H   -2.299800       2.450000       1.387700    
 H   -2.014400       2.871600     -0.2799000    
 H   -1.680500      0.1100000       2.093600    
 H    5.510700     -0.6126000       1.838500    
 H    5.008200      -2.285800       1.589000    
 H    7.161200      -1.896900      0.5332000    
 H    5.936000      -2.249900     -0.7096000    
 H   -3.888700      0.6211000       1.956600    
 H   -3.115800       1.735300      -2.137500    
 H   -5.876700     -0.5893000       1.266900    
 H   -5.125700      0.4983000      -2.847800    
 H   -7.789400      -1.647000      0.3348000    
 H   -6.242100      -2.469200     -3.8800001E-02
 H    8.568800      0.9652000      -2.850600    
 H    7.348100       1.807900      -1.954600    
 H    8.991700      -1.160900      -2.625100    
 H    8.161600      -2.218400      -1.541500    
 H   -8.706300      -2.510700      -1.822700    
 H   -7.165200      -3.280100      -2.180000    
 H   -8.131200      -3.845600     -0.7959000    


%chk=000135084-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135084

0 1
O 0.203416 -2.521814 1.081708
O 0.658811 2.273598 -1.544044
O -7.195158 -0.792236 -0.607215
N 1.642738 0.352104 -0.689352
N -0.787881 -0.711996 0.022833
N 6.816216 0.233292 0.024740
N 8.090857 2.144158 -0.474999
N 9.208306 0.081787 -0.383700
C 1.650813 -1.063797 -0.259878
C -0.822243 0.425450 -0.915829
C 2.815715 -1.328318 0.723395
C 4.207019 -1.196831 0.068065
C 0.299666 -1.492348 0.347408
C -1.886239 1.469627 -0.464703
C 0.554378 1.099299 -1.073742
C 5.357453 -1.460520 1.061967
C -3.293988 0.895365 -0.461557
C 6.741864 -1.184160 0.436524
C -3.922575 0.486837 0.739506
C -4.011048 0.722375 -1.678775
C -5.218949 -0.081055 0.745612
C -5.299230 0.161667 -1.694707
C -5.909529 -0.246731 -0.480021
C 7.982706 0.759509 -0.266896
C -7.882368 -1.231846 0.624236
C -9.244238 -1.774030 0.199492
H 1.808049 -1.718418 -1.148187
H -1.114269 0.067869 -1.928868
H 2.671512 -2.346660 1.127410
H 2.728009 -0.627725 1.577217
H 4.377809 -0.182699 -0.346244
H 4.283147 -1.906791 -0.783320
H 2.556012 0.802043 -0.809896
H -1.607991 1.831101 0.542278
H -1.795825 2.325991 -1.155487
H -1.693155 -1.026075 0.391747
H 5.237492 -0.801762 1.944095
H 5.315812 -2.508781 1.422054
H 7.533666 -1.452280 1.177445
H 6.874018 -1.864254 -0.438993
H -3.401088 0.628209 1.694823
H -3.556005 1.044777 -2.623783
H -5.669938 -0.379834 1.696283
H -5.856370 0.034239 -2.627971
H -7.988599 -0.369430 1.314277
H -7.275341 -2.013847 1.125464
H 8.744383 2.495000 -1.173960
H 7.226076 2.664606 -0.335722
H 10.086284 0.577304 -0.245680
H 9.220472 -0.933120 -0.346299
H -9.834673 -0.990878 -0.305731
H -9.125421 -2.622141 -0.496053
H -9.807280 -2.122333 1.084433


