%chk=000000136.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000136

1 1
 O   -4.881800      -2.278700     -0.2694000    
 O    3.695500      -2.010200      -1.614300    
 O    7.698600      -1.927000       1.448000    
 O    5.861100      -1.171600       2.544900    
 O    7.506400       3.417200     -0.5458000    
 O    7.943200       1.897100      -2.172600    
 N   -3.980800      0.3639000      0.4140000    
 N   -1.764900      0.3973000      0.4727000    
 N   -5.860700       2.307400      0.4833000    
 N   -7.525500      0.6832000     -0.1856000    
 N   -7.006500      -1.557500     -0.7009000    
 N   -9.184200     -0.7081000     -0.9580000    
 N    4.457800     -0.8921000      0.2687000    
 C   -3.670300       1.588900       1.186700    
 C   -2.143100       1.699700       1.060700    
 C   -4.478600       2.741300      0.6086000    
 C   -2.857900     -0.2545000      0.1104000    
 C   -5.284300      4.0600002E-02  7.9099998E-02
 C   -6.229200       1.012500      0.1381000    
 C  -0.5117000     -1.1800000E-02  0.2108000    
 C   -5.689700      -1.356900     -0.3165000    
 C   0.5852000      0.7470000      0.6375000    
 C  -0.2874000      -1.203000     -0.4908000    
 C   -7.863800     -0.5754000     -0.6156000    
 C    1.885800      0.3215000      0.3669000    
 C    1.013200      -1.628600     -0.7612000    
 C    2.099700     -0.8663000     -0.3324000    
 C    5.854100      -1.229500      0.1101000    
 C    3.455700      -1.309500     -0.6150000    
 C    6.614000     -0.2159000     -0.7542000    
 C    6.680000       1.214600     -0.2041000    
 C    6.441100      -1.414100       1.494500    
 C    7.429200       2.178300      -1.098800    
 H   -3.949600       1.402700       2.232300    
 H   -1.838100       2.509800      0.3898000    
 H   -1.684800       1.827700       2.046700    
 H   -4.107400       3.019800     -0.3845000    
 H   -4.414100       3.624000       1.252500    
 H   -2.863300      -1.178800     -0.4315000    
 H   -6.596100       3.006000      0.4663000    
 H   -8.211400       1.428500     -0.1405000    
 H   0.4579000       1.680400       1.177800    
 H   -1.082200      -1.844400     -0.8521000    
 H    2.701400      0.9615000      0.6905000    
 H    1.160200      -2.559100      -1.303600    
 H    5.895900      -2.210000     -0.3809000    
 H    7.640000     -0.5752000     -0.9076000    
 H    6.154000     -0.1848000      -1.750900    
 H   -9.553300      -1.591100      -1.293600    
 H   -9.830800      6.9799997E-02 -0.8846000    
 H    4.211100     -0.3476000       1.088700    
 H    5.665300       1.606900     -7.4500002E-02
 H    7.182100       1.209300      0.7697000    
 H    8.071700      -2.061300       2.345100    
 H    8.006800       4.040500      -1.114400    


%chk=000000136-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000136

1 1
O -4.739949 -1.547243 -1.802503
O 3.924875 -2.117155 -1.072721
O 8.042331 -1.152067 1.836640
O 6.193262 -0.055689 2.720675
O 7.431011 3.012028 -1.941011
O 7.726243 0.974935 -3.020398
N -4.089444 0.335830 0.245567
N -1.871677 0.263120 0.549736
N -6.105531 2.097040 1.057236
N -7.675230 0.885701 -0.295075
N -7.019290 -0.969453 -1.699872
N -9.259392 -0.323618 -1.581362
N 4.632251 -0.709324 0.631357
C -3.889013 1.143429 1.497922
C -2.342011 1.267837 1.567781
C -4.704646 2.450745 1.358759
C -2.920178 -0.167687 -0.195424
C -5.387297 0.195085 -0.294463
C -6.374486 1.066789 0.172601
C -0.498262 -0.107868 0.388336
C -5.675241 -0.830016 -1.317325
C 0.510778 0.658823 1.021289
C -0.144596 -1.235050 -0.399516
C -7.950785 -0.166505 -1.204806
C 1.864791 0.302242 0.861341
C 1.208475 -1.570240 -0.558755
C 2.231363 -0.815559 0.072420
C 6.041236 -1.110680 0.494901
C 3.654981 -1.263201 -0.169079
C 6.744609 -0.496335 -0.752296
C 6.775373 1.041634 -0.732566
C 6.732200 -0.712754 1.797135
C 7.355614 1.613251 -2.013372
H -4.289020 0.556982 2.345389
H -1.984115 2.275553 1.286803
H -1.948841 1.010730 2.563200
H -4.272305 3.078344 0.554728
H -4.673819 3.021884 2.301243
H -2.895941 -0.833131 -1.059882
H -6.858853 2.621930 1.500405
H -8.401663 1.562747 -0.051172
H 0.261843 1.538364 1.623029
H -0.908469 -1.859940 -0.873392
H 2.622876 0.929808 1.341712
H 1.509932 -2.425805 -1.171351
H 6.096294 -2.211591 0.383726
H 7.770201 -0.900553 -0.802854
H 6.210576 -0.858753 -1.646647
H -9.449045 -1.062379 -2.257779
H -10.037932 0.200592 -1.188720
H 4.414887 -0.147719 1.461535
H 5.757046 1.458628 -0.608505
H 7.372090 1.437773 0.111822
H 8.477989 -0.883917 2.690784
H 7.819403 3.366807 -2.786730


