%chk=000035350.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035350

0 1
 O  -0.1109000      0.2552000      -1.833900    
 N    4.079100      8.5000005E-03  8.3999997E-03
 N   0.4384000      0.6900000      0.3774000    
 N   -5.819700     -0.5399000      0.8326000    
 C    2.671400     -0.2936000      0.2649000    
 C    1.830900      0.9702000      0.1562000    
 C    4.883700      -1.211000      7.4800000E-02
 C    4.571900      0.9988000      0.9651000    
 C   -1.846000      0.1165000     -0.2626000    
 C  -0.4314000      0.3502000     -0.6521000    
 C    4.392800      -2.253800     -0.9080000    
 C    6.011900       1.374300      0.6827000    
 C   -2.727800       1.180400     -0.2675000    
 C   -2.241900      -1.158500      9.3900003E-02
 C   -4.055900      0.9608000      9.8200001E-02
 C   -3.570000      -1.378000      0.4593000    
 C   -4.477100     -0.3183000      0.4615000    
 C   -2.306200       2.561200     -0.6526000    
 C   -1.293100      -2.312900      0.1014000    
 H    2.530900     -0.7560000       1.251300    
 H    2.273100     -0.9938000     -0.4773000    
 H    1.951600       1.440300     -0.8266000    
 H    2.071300       1.708000      0.9253000    
 H    5.920400      -1.001800     -0.2089000    
 H    4.898100      -1.636900       1.086200    
 H    4.027400       1.942300      0.8752000    
 H    4.472200      0.6546000       2.002200    
 H   8.2900003E-02  0.7423000       1.328000    
 H    5.145500      -3.044000      -1.010200    
 H    3.473600      -2.745700     -0.5747000    
 H    4.230400      -1.830900      -1.905400    
 H    6.715600      0.5916000      0.9823000    
 H    6.171500       1.609100     -0.3754000    
 H    6.279500       2.268200       1.257800    
 H   -4.767000       1.784000      0.1020000    
 H   -3.903200      -2.373500      0.7442000    
 H   -1.551000       2.940200      4.3699998E-02
 H   -1.900300       2.570900      -1.669500    
 H   -3.146500       3.263800     -0.6347000    
 H  -0.8472000      -2.452100     -0.8889000    
 H  -0.4987000      -2.151700      0.8375000    
 H   -1.794500      -3.251100      0.3632000    
 H   -6.126300      -1.467500       1.094100    
 H   -6.478400      0.2276000      0.8324000    


%chk=000035350-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035350

0 1
O 0.245919 -1.049738 -1.163349
N 4.153650 0.198468 0.379553
N 0.405090 0.871622 0.123581
N -5.955847 -0.417794 0.743736
C 2.721589 0.115943 0.761324
C 1.846881 1.032532 -0.137087
C 4.638968 -1.004924 -0.347857
C 5.056492 0.630129 1.477841
C -1.795704 -0.193492 -0.105650
C -0.323807 -0.169486 -0.434889
C 3.926860 -1.239595 -1.693921
C 6.374715 1.252569 0.975149
C -2.649455 0.913722 -0.402505
C -2.355283 -1.389163 0.449925
C -4.030391 0.823802 -0.120769
C -3.732619 -1.444543 0.737707
C -4.591645 -0.344081 0.460778
C -2.136157 2.193410 -1.053728
C -1.488842 -2.602467 0.744670
H 2.587815 0.411617 1.821513
H 2.336802 -0.920623 0.666311
H 2.039557 0.772366 -1.190634
H 2.130133 2.089372 0.014238
H 5.719625 -0.871449 -0.537184
H 4.533808 -1.922865 0.288179
H 4.516910 1.394136 2.068850
H 5.289803 -0.211895 2.180904
H -0.070836 1.510622 0.761492
H 4.348176 -2.135179 -2.188039
H 2.840836 -1.402597 -1.571577
H 4.074328 -0.372659 -2.363229
H 7.001848 0.521201 0.434620
H 6.159358 2.090922 0.289511
H 6.967848 1.632765 1.827982
H -4.683903 1.669926 -0.369853
H -4.151488 -2.358596 1.177414
H -1.777677 2.925711 -0.303203
H -1.299405 2.000217 -1.745212
H -2.944515 2.685878 -1.621858
H -1.070435 -3.016688 -0.188725
H -0.623419 -2.339966 1.381804
H -2.069474 -3.387055 1.259431
H -6.360712 -1.263466 1.133853
H -6.574400 0.359392 0.532401


