%chk=000121107.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121107

0 1
 O   -1.047400       1.390800     -0.1671000    
 O   0.7659000       2.088800       1.082500    
 N   -3.785800      0.7533000      0.1783000    
 C    1.037400      0.4471000     -0.6606000    
 C    2.533200      0.5385000     -0.4019000    
 C   0.4170000     -0.9361000     -0.6498000    
 C    2.710400      -1.284100       1.462900    
 C    1.209000      -1.348300       1.714900    
 C    3.257600     -0.2050000      0.5524000    
 C   0.4649000      -1.770300      0.4793000    
 C   0.2663000       1.407500      0.1975000    
 C    3.231100       1.501600      -1.171100    
 C  -0.2654000      -1.388600      -1.795000    
 C    4.651100      1.4900000E-02  0.6657000    
 C  -0.1613000      -3.027800      0.4435000    
 C   -3.321500       2.126200      4.6999998E-02
 C   -1.902700       2.265800      0.5752000    
 C    4.602300       1.709100      -1.031500    
 C  -0.8821000      -2.639600      -1.820100    
 C    5.316100      0.9596000     -0.1124000    
 C  -0.8312000      -3.459100     -0.6994000    
 C   -3.760200      0.3292000       1.580300    
 C   -5.137200      0.6087000     -0.3686000    
 C   -4.177500      -1.124900       1.721700    
 C   -5.189900       1.042800      -1.823700    
 H   0.8978000      0.8323000      -1.683000    
 H    3.182300      -1.156200       2.447100    
 H    3.054300      -2.251800       1.072100    
 H    1.025600      -2.074800       2.517300    
 H   0.8210000     -0.3975000       2.093500    
 H    2.697300       2.109600      -1.899900    
 H  -0.3274000     -0.7621000      -2.682000    
 H    5.234000     -0.5642000       1.380400    
 H  -0.1254000      -3.684600       1.309300    
 H   -3.980700       2.832600      0.5668000    
 H   -3.275000       2.419900      -1.006900    
 H   -1.573100       3.296300      0.3885000    
 H   -1.807100       2.097200       1.652200    
 H    5.105800       2.453100      -1.641200    
 H   -1.404200      -2.969800      -2.713300    
 H    6.385500       1.106800      3.3000000E-03
 H   -1.310400      -4.433400     -0.7141000    
 H   -4.393100      0.9631000       2.213700    
 H   -2.745500      0.3626000       1.986200    
 H   -5.876500       1.175500      0.2113000    
 H   -5.444800     -0.4420000     -0.3624000    
 H   -3.928700      -1.482000       2.727700    
 H   -3.651400      -1.769300       1.008900    
 H   -5.255900      -1.265100       1.600700    
 H   -6.131000      0.7040000      -2.271900    
 H   -4.375200      0.6037000      -2.409800    
 H   -5.167900       2.131100      -1.937700    


%chk=000121107-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121107

0 1
O -1.058033 2.034724 -0.829469
O -0.303233 1.407926 1.289738
N -3.567902 0.827142 0.445388
C 0.812744 0.531093 -0.782521
C 2.221438 0.684574 -0.180384
C 0.296538 -0.884596 -1.077891
C 2.234322 -1.444217 1.384304
C 0.698525 -1.631487 1.335330
C 2.830404 -0.164676 0.789863
C 0.202585 -1.890819 -0.075072
C -0.222437 1.331937 0.044381
C 2.946781 1.815517 -0.650435
C -0.116471 -1.180135 -2.399886
C 4.139545 0.165219 1.241731
C -0.307819 -3.163596 -0.431265
C -3.498818 2.064164 -0.359297
C -2.168750 2.819668 -0.223719
C 4.240840 2.126624 -0.192070
C -0.619393 -2.453805 -2.744990
C 4.846425 1.286894 0.769345
C -0.719168 -3.452789 -1.751717
C -3.746380 1.090899 1.899897
C -4.559127 -0.146484 -0.089781
C -3.253570 -0.067502 2.786940
C -4.088663 -0.858451 -1.372202
H 0.831239 1.051176 -1.755848
H 2.553416 -1.495810 2.443624
H 2.706195 -2.313644 0.880138
H 0.436703 -2.494992 1.974891
H 0.215700 -0.739052 1.770869
H 2.475575 2.466982 -1.397536
H -0.046207 -0.400617 -3.167939
H 4.608527 -0.486167 1.990560
H -0.378895 -3.938466 0.342021
H -4.318593 2.789325 -0.105057
H -3.629694 1.799380 -1.423137
H -2.202022 3.755724 -0.807075
H -1.910219 3.038520 0.826616
H 4.767286 3.006020 -0.578747
H -0.929796 -2.661223 -3.774946
H 5.852090 1.504314 1.146102
H -1.110113 -4.445532 -2.001787
H -4.814918 1.331847 2.137738
H -3.154095 1.986619 2.158407
H -5.551827 0.343756 -0.267557
H -4.725971 -0.910715 0.690159
H -3.375970 0.190746 3.855550
H -2.184608 -0.252307 2.588379
H -3.811125 -1.003692 2.602934
H -4.843389 -1.601036 -1.693533
H -3.132468 -1.378285 -1.192535
H -3.936805 -0.155597 -2.211713


