%chk=000256334.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256334

0 1
S -2.405793 -0.214893 1.064937
N 2.517104 0.451483 0.615435
N 0.718120 0.097292 2.008915
N -1.120270 0.133673 -1.269999
N 1.285541 0.462565 -1.573922
C -3.815616 -0.296513 -0.098564
C -5.083360 -0.039395 0.725868
C -3.953769 -1.690921 -0.715058
C -6.168319 -0.956006 0.122955
C -5.469801 -1.925113 -0.852885
C -1.001696 0.039098 0.069571
C 0.268120 0.146971 0.683493
C 3.916606 0.604945 0.175574
C 1.393499 0.361006 -0.207284
C 4.645269 -0.747578 0.176273
C 6.108687 -0.577726 -0.251426
C 2.046867 0.269788 1.952378
C 0.019078 0.341640 -2.030818
C 6.846733 -1.913639 -0.252573
H -3.685573 0.473904 -0.893321
H -5.380127 1.022694 0.683864
H -4.948019 -0.272715 1.799297
H -3.501381 -2.472528 -0.077050
H -3.434086 -1.752660 -1.687475
H -6.935561 -0.361640 -0.401097
H -6.694481 -1.509599 0.918567
H -5.730212 -2.972820 -0.631243
H -5.799535 -1.735492 -1.888924
H 3.919356 1.046746 -0.852166
H 4.425647 1.333593 0.846365
H 4.129921 -1.452890 -0.508319
H 4.592832 -1.216347 1.178052
H 6.156967 -0.125629 -1.262733
H 6.624212 0.132233 0.425158
H 2.719298 0.287626 2.799724
H 7.891082 -1.788228 -0.562121
H 6.853862 -2.376285 0.741179
H 6.386592 -2.630492 -0.943380
H -0.138193 0.413253 -3.119448


%chk=000256334-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256334

0 1
S -2.445804 -0.087113 1.366071
N 2.533394 0.544620 0.790398
N 0.746799 0.388488 2.236337
N -1.071682 -0.072224 -1.034942
N 1.340715 0.235836 -1.359633
C -3.791489 -0.383037 0.056549
C -5.183440 -0.046136 0.642432
C -3.912144 -1.849728 -0.403618
C -6.182312 -0.849063 -0.256290
C -5.316226 -1.877002 -1.067032
C -0.973594 0.029112 0.323656
C 0.303384 0.239660 0.909905
C 3.920335 0.655936 0.300079
C 1.404477 0.330185 -0.002417
C 4.602949 -0.718295 0.115468
C 6.046897 -0.573937 -0.415104
C 2.076503 0.563985 2.116948
C 0.063862 0.036592 -1.796694
C 6.739865 -1.938987 -0.614289
H -3.525065 0.265109 -0.795240
H -5.381461 1.039331 0.643769
H -5.246846 -0.395696 1.690599
H -3.883330 -2.519663 0.477085
H -3.095439 -2.138628 -1.085080
H -6.730271 -0.175452 -0.938675
H -6.936853 -1.361370 0.366565
H -5.755867 -2.889928 -1.063657
H -5.237766 -1.558162 -2.122969
H 3.885251 1.189421 -0.666761
H 4.487888 1.279177 1.015870
H 4.003917 -1.322436 -0.592202
H 4.610149 -1.260860 1.081787
H 6.029542 -0.024816 -1.378310
H 6.641561 0.044164 0.288556
H 2.755828 0.716731 2.953710
H 7.767630 -1.815112 -1.000979
H 6.802173 -2.497264 0.338547
H 6.180628 -2.564760 -1.334405
H -0.074558 -0.049280 -2.878238


