%chk=000034886.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034886

1 1
 O   -1.956400      -2.640900      0.2539000    
 N   -4.049500       1.373900     -0.2727000    
 N  -0.9114000     -0.5802000      0.4015000    
 N   0.2212000      0.1763000      0.3397000    
 C   -2.792200      0.6596000     -0.6050000    
 C   -2.126100      0.1727000      0.6685000    
 C   -3.769500       2.574500      0.6421000    
 C   -4.734300       1.893000      -1.544600    
 C   -5.031500      0.4421000      0.4511000    
 C  -0.9336000      -1.955500      0.2158000    
 C   0.3774000      -2.617300     -3.5399999E-02
 C    1.342200     -0.4221000      9.7499996E-02
 C    1.487100      -1.877700     -9.2699997E-02
 C    2.584800      0.3903000      2.0099999E-02
 C   0.3865000      -4.105200     -0.2029000    
 C    3.638800     -2.8899999E-02 -0.7889000    
 C    2.691100       1.568300      0.7564000    
 C    4.804700      0.7334000     -0.8618000    
 C    3.857100       2.330600      0.6833000    
 C    4.913800       1.912900     -0.1258000    
 H   -3.036700     -0.1769000      -1.271200    
 H   -2.137600       1.347500      -1.154300    
 H   -1.839700      0.9943000       1.332800    
 H   -2.777100     -0.4947000       1.239300    
 H   -2.965900       3.168100      0.1968000    
 H   -4.685400       3.170600      0.7089000    
 H   -3.503000       2.227300       1.643100    
 H   -4.044300       2.577600      -2.046400    
 H   -4.958000       1.034100      -2.184100    
 H   -5.654700       2.413100      -1.263100    
 H   -4.687000      0.2529000       1.470400    
 H   -6.003300      0.9442000      0.4979000    
 H   -5.115200     -0.4855000     -0.1225000    
 H    2.454700      -2.340700     -0.2341000    
 H  -0.2305000      -4.397500      -1.058900    
 H  -7.6000001E-03  -4.593800      0.6943000    
 H    1.396500      -4.492400     -0.3748000    
 H    3.582700     -0.9196000      -1.407200    
 H    1.884100       1.909800       1.399000    
 H    5.624600      0.4133000      -1.498300    
 H    3.942900       3.248500       1.257400    
 H    5.820900       2.507300     -0.1838000    


%chk=000034886-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034886

1 1
O -2.263319 -1.878537 0.104671
N -4.255926 1.205503 -0.199539
N -0.744553 -0.127141 0.373150
N 0.496243 0.486064 0.357805
C -2.751577 1.017725 -0.502796
C -1.871500 0.748689 0.744687
C -4.481816 2.471863 0.621059
C -4.980377 1.334897 -1.540795
C -4.823531 -0.016090 0.545765
C -1.041702 -1.486076 0.084120
C 0.128068 -2.315305 -0.211012
C 1.552917 -0.304639 0.061333
C 1.377631 -1.714630 -0.215532
C 2.887864 0.348645 0.049877
C -0.111647 -3.776490 -0.476529
C 3.984541 -0.238068 -0.639268
C 3.085232 1.584079 0.726980
C 5.246446 0.392587 -0.645716
C 4.346305 2.210861 0.719640
C 5.433818 1.617118 0.034773
H -2.695354 0.150020 -1.178005
H -2.419726 1.923972 -1.037692
H -1.431450 1.671500 1.149046
H -2.451041 0.234248 1.529742
H -4.153170 3.345987 0.037676
H -5.553555 2.559177 0.856818
H -3.904862 2.407633 1.555298
H -4.513001 2.137379 -2.131822
H -4.901979 0.378028 -2.078468
H -6.038852 1.573455 -1.356047
H -4.634293 0.090493 1.623520
H -5.909090 -0.054052 0.370314
H -4.316232 -0.922834 0.178458
H 2.262323 -2.328289 -0.406582
H -0.790229 -3.910453 -1.338963
H -0.619691 -4.249460 0.383785
H 0.828971 -4.313875 -0.675542
H 3.861393 -1.173377 -1.195973
H 2.244645 2.035453 1.262206
H 6.080454 -0.068324 -1.184830
H 4.487017 3.156892 1.252861
H 6.415205 2.102676 0.032825


