%chk=000157609.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157609

0 1
 O    1.432200      0.7662000      -3.204900    
 O  -0.5923000      0.9167000     -0.9459000    
 O    3.894800      0.3780000     -5.9700001E-02
 O    2.184300      -4.471300       1.865000    
 O   -1.507000       2.712000      0.1846000    
 O    2.534400      0.8628000       1.779100    
 C    1.625600      0.7431000      -1.784900    
 C    2.610900       1.408100      -2.701400    
 C    1.950600     -0.5727000      -1.159700    
 C   0.6496000       1.599500      -1.060600    
 C    3.061600     -0.7104000     -0.3275000    
 C    1.130100      -1.671400      -1.415300    
 C    3.352100      -1.947100      0.2489000    
 C    1.420500      -2.907900     -0.8390000    
 C    2.531500      -3.045700     -6.8000001E-03
 C    2.842200      -4.368400      0.6081000    
 C   -1.584600       1.593300     -0.2980000    
 C    3.495500       1.104900       1.060300    
 C    4.464400       2.258700       1.259900    
 C   -2.787400      0.7302000     -0.2769000    
 C    3.750600       3.464500       1.865100    
 C    5.622700       1.809900       2.142800    
 C   -3.908100       1.173200      0.3106000    
 C   -5.168900      0.4142000      0.3871000    
 C   -5.160900     -0.9704000      0.2177000    
 C   -6.370500       1.080200      0.6290000    
 C   -6.354200      -1.688900      0.2897000    
 C   -7.563900      0.3616000      0.7012000    
 C   -7.555600      -1.022900      0.5315000    
 H    3.559100      0.9284000      -2.910200    
 H    2.647600       2.489800      -2.738800    
 H   0.4825000       2.540900      -1.600100    
 H    1.020000       1.852900     -6.2899999E-02
 H   0.2617000      -1.580300      -2.062600    
 H    4.218900      -2.048200      0.8975000    
 H   0.7728000      -3.756000      -1.044800    
 H    2.507500      -5.189900     -3.4899998E-02
 H    3.920400      -4.487300      0.7623000    
 H    4.846600       2.560600      0.2767000    
 H   -2.710200     -0.2340000     -0.7658000    
 H    3.360500       3.240200       2.864100    
 H    4.431300       4.317900       1.949900    
 H    2.902800       3.766200       1.240300    
 H    5.270200       1.494500       3.131300    
 H    6.347200       2.619100       2.279500    
 H    6.146100      0.9581000       1.695000    
 H    2.409500      -5.342500       2.233800    
 H   -3.934500       2.161700      0.7635000    
 H   -4.247800      -1.533300      4.7899999E-02
 H   -6.396100       2.159000      0.7622000    
 H   -6.348000      -2.767500      0.1624000    
 H   -8.499600      0.8799000      0.8895000    
 H   -8.484700      -1.582500      0.5889000    


%chk=000157609-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157609

0 1
O 0.808464 1.035828 -2.178496
O -0.865703 0.749597 0.351973
O 4.149047 0.208461 0.008305
O 4.637624 -4.626701 0.594701
O -2.015312 2.736867 -0.157376
O 3.147490 1.181372 1.891674
C 1.318308 0.824658 -0.759404
C 2.064421 1.716459 -1.712520
C 1.828277 -0.564571 -0.482897
C 0.428765 1.480285 0.288168
C 3.159650 -0.836133 -0.090496
C 0.957694 -1.674698 -0.630149
C 3.626692 -2.143407 0.139185
C 1.405473 -2.988956 -0.400919
C 2.747421 -3.234511 -0.013395
C 3.218909 -4.657831 0.229798
C -2.027671 1.502734 0.077690
C 4.065972 1.165533 1.047667
C 5.238858 2.135949 0.976602
C -3.211237 0.623124 0.137843
C 4.704551 3.574835 0.751233
C 6.057060 2.043601 2.291587
C -4.461626 1.129035 -0.091417
C -5.737122 0.401004 -0.070729
C -5.838088 -0.992113 0.217498
C -6.934379 1.121014 -0.350889
C -7.090523 -1.634992 0.223330
C -8.189040 0.477191 -0.345419
C -8.272219 -0.904740 -0.058054
H 2.986351 1.343720 -2.173607
H 1.981432 2.806363 -1.606715
H 0.220623 2.533221 0.029851
H 0.890380 1.402050 1.285541
H -0.073517 -1.485156 -0.940498
H 4.664184 -2.319301 0.430898
H 0.709491 -3.827128 -0.529176
H 2.610470 -5.111628 1.042901
H 3.059688 -5.260683 -0.691235
H 5.873593 1.838188 0.124011
H -3.021806 -0.428853 0.372025
H 4.024547 3.866142 1.571134
H 5.548111 4.287291 0.726331
H 4.156058 3.661094 -0.204337
H 5.421355 2.295452 3.158531
H 6.901388 2.754850 2.256247
H 6.466669 1.029270 2.444525
H 4.959023 -5.545627 0.766337
H -4.515345 2.204207 -0.318613
H -4.934803 -1.571193 0.438567
H -6.870956 2.193061 -0.574136
H -7.152302 -2.705779 0.447194
H -9.097726 1.048559 -0.563849
H -9.244664 -1.409315 -0.052318


