%chk=000101877.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101877

0 1
 O    2.588700     -0.3655000       1.653800    
 O    3.526700     -3.7599999E-02 -0.3977000    
 C    1.128000      0.1314000     -0.1214000    
 C   0.7686000     -0.9312000      -1.172700    
 C   0.9855000       1.573100     -0.6545000    
 C   0.3495000      -2.286600     -0.5749000    
 C   0.1076000       2.457600      0.2527000    
 C  -0.8782000      -2.262500      0.3500000    
 C   -1.349900       2.625200     -0.2046000    
 C   -2.177800      -1.812700     -0.3315000    
 C   -2.150400       1.344300     -0.4513000    
 C   -3.032700     -0.8590000      0.5170000    
 C   -2.409800      0.5151000      0.8079000    
 C    2.544200     -9.1499999E-02  0.3271000    
 H   0.4850000      1.4700000E-02  0.7498000    
 H    1.621400      -1.106400      -1.841600    
 H  -3.5000000E-02 -0.5732000      -1.821600    
 H   0.5926000       1.589900      -1.677700    
 H    1.972900       2.049700     -0.7109000    
 H    1.195500      -2.705700     -1.6400000E-02
 H   0.1526000      -2.981400      -1.400900    
 H   0.5486000       3.463400      0.2642000    
 H   0.1426000       2.114300       1.292900    
 H  -0.6642000      -1.672800       1.245100    
 H   -1.031100      -3.284700      0.7218000    
 H   -1.346800       3.202400      -1.138500    
 H   -1.877700       3.243600      0.5320000    
 H   -2.779400      -2.709800     -0.5299000    
 H   -1.995100      -1.375700      -1.316100    
 H   -1.648000      0.7586000      -1.220600    
 H   -3.120900       1.624600     -0.8810000    
 H   -3.265200      -1.346300       1.472000    
 H   -3.992000     -0.7079000      6.2000002E-03
 H   -3.101400       1.073800       1.451600    
 H   -1.500300      0.3908000       1.397600    
 H    3.506300     -0.5161000       1.966200    


%chk=000101877-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101877

0 1
O 2.510644 -0.910575 1.532132
O 3.607620 0.378415 -0.049860
C 1.128105 0.181168 -0.133762
C 0.785503 -0.938195 -1.177719
C 0.986159 1.634625 -0.690862
C 0.396593 -2.309308 -0.564197
C 0.091768 2.555579 0.194761
C -0.835649 -2.277278 0.382576
C -1.388933 2.683627 -0.265108
C -2.170741 -1.834343 -0.289172
C -2.174352 1.361046 -0.461079
C -3.041223 -0.867423 0.562483
C -2.420040 0.533155 0.822946
C 2.528838 -0.061951 0.407443
H 0.437977 0.056187 0.715740
H 1.637027 -1.065826 -1.874997
H -0.055213 -0.561846 -1.790477
H 0.571553 1.598251 -1.717101
H 1.995507 2.073885 -0.789965
H 1.258761 -2.722348 -0.005614
H 0.193639 -3.010688 -1.399565
H 0.520003 3.577451 0.206751
H 0.133224 2.202592 1.244865
H -0.609436 -1.619906 1.244158
H -0.961229 -3.288048 0.817658
H -1.400604 3.233969 -1.228820
H -1.928550 3.323790 0.463742
H -2.776555 -2.731564 -0.524570
H -1.960835 -1.359378 -1.266739
H -1.641992 0.742462 -1.208065
H -3.157351 1.599495 -0.917880
H -3.259673 -1.347257 1.538855
H -4.019572 -0.732515 0.055733
H -3.095116 1.102725 1.494208
H -1.473892 0.415938 1.386151
H 3.448435 -1.070010 1.829450


