%chk=000227091.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227091

0 1
 O   -1.514700       2.185200      0.1525000    
 O    1.514400      -2.181700     -0.1541000    
 O   -3.589600      0.7312000      -1.249900    
 O    3.590000     -0.7277000       1.251700    
 N    1.059800       2.534300     -0.5195000    
 N   -1.059500      -2.530700      0.5217000    
 N   -2.726400     -0.2089000      0.6983000    
 N    2.726800      0.2124000     -0.6965000    
 C    2.278900       2.960900      0.1592000    
 C   0.9488000       3.495500      0.5727000    
 C   -2.278500      -2.957200     -0.1570000    
 C  -0.9485000      -3.491900     -0.5704000    
 C   0.6206000       1.257300     -0.2808000    
 C  -0.6202000      -1.253600      0.2828000    
 C   -1.402300     -0.1669000      0.3661000    
 C    1.402600      0.1706000     -0.3641000    
 C  -0.8173000       1.174800      8.3899997E-02
 C   0.8175000      -1.171100     -8.2500003E-02
 C   -3.742000      0.2441000     -0.1326000    
 C    3.742400     -0.2407000      0.1343000    
 C   -5.105200      6.6699997E-02  0.5148000    
 C    5.105800     -5.9700001E-02 -0.5115000    
 C   -6.242800      0.5565000     -0.3766000    
 C    6.243500     -0.5496000      0.3798000    
 C   -7.597300      0.3390000      0.2776000    
 C    7.593300     -0.3888000     -0.2998000    
 H    2.757600       2.302300      0.8686000    
 H    2.914300       3.579400     -0.4570000    
 H   0.6640000       4.482900      0.2411000    
 H   0.5380000       3.145700       1.509300    
 H   -2.914000      -3.575700      0.4591000    
 H   -2.757200      -2.298800     -0.8666000    
 H  -0.5379000      -3.142200      -1.507200    
 H  -0.6637000      -4.479300     -0.2389000    
 H   -2.994700     -0.9091000       1.386400    
 H    2.995000      0.9129000      -1.384300    
 H   -5.241000     -0.9981000      0.7397000    
 H   -5.108600      0.6154000       1.464100    
 H    5.108800     -0.6090000      -1.460500    
 H    5.241800       1.004900     -0.7371000    
 H   -6.218300      2.9899999E-02  -1.338200    
 H   -6.112500       1.623000     -0.5959000    
 H    6.244000      7.1000000E-03   1.324500    
 H    6.091600      -1.605400      0.6342000    
 H   -7.666200      0.8809000       1.226200    
 H   -8.397000      0.6982000     -0.3777000    
 H   -7.771600     -0.7235000      0.4750000    
 H    7.790400      0.6616000     -0.5367000    
 H    8.393300     -0.7448000      0.3569000    
 H    7.635500     -0.9649000      -1.229700    


%chk=000227091-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227091

0 1
O -1.123561 2.065424 1.393482
O 1.123794 -2.074896 -1.393165
O -3.768950 -0.288809 -1.463804
O 3.768141 0.280598 1.465545
N 1.455541 2.321716 0.543701
N -1.455250 -2.331429 -0.543288
N -2.816307 0.095270 0.642103
N 2.816751 -0.105502 -0.640607
C 2.710992 3.009112 0.871453
C 1.351659 3.460375 1.450255
C -2.710931 -3.017616 -0.873012
C -1.351508 -3.469005 -1.451363
C 0.859312 1.127542 0.338211
C -0.859012 -1.137204 -0.337635
C -1.435472 -0.018299 0.277703
C 1.435788 0.008482 -0.276859
C -0.620898 1.102115 0.703878
C 0.621185 -1.111805 -0.703204
C -3.883897 0.086300 -0.256537
C 3.883889 -0.095197 0.258490
C -5.217457 0.562036 0.328539
C 5.218465 -0.569506 -0.325005
C -6.402017 -0.336821 -0.099642
C 6.398421 0.341992 0.089900
C -7.761193 0.230974 0.358096
C 7.759975 -0.221909 -0.365631
H 3.405427 2.466292 1.518157
H 3.157484 3.593529 0.058163
H 0.861928 4.356223 1.053714
H 1.131064 3.240345 2.499313
H -3.158447 -3.602833 -0.060872
H -3.404528 -2.473504 -1.519544
H -1.129966 -3.247765 -2.499960
H -0.862709 -4.365700 -1.055599
H -2.958376 0.629906 1.507555
H 2.959028 -0.641220 -1.505362
H -5.165964 0.630107 1.432560
H -5.394885 1.589044 -0.050642
H 5.403678 -1.590507 0.066230
H 5.165020 -0.650794 -1.428003
H -6.259734 -1.353648 0.317757
H -6.376736 -0.439692 -1.199824
H 6.248236 1.353266 -0.338103
H 6.375705 0.456208 1.189044
H -7.939699 1.231907 -0.078432
H -8.592752 -0.426126 0.044854
H -7.807458 0.331438 1.459073
H 7.803813 -0.333811 -1.465594
H 8.588164 0.443777 -0.061738
H 7.945950 -1.216982 0.081049


